Phosphorous Acid, 2-ethylhexyl Diphenyl Ester
fo-998f93ef159fb420
Identity
- Type
- Neutral molecule
- CAS
- 15647-08-2
- EC
- 239-716-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
9- 2-Ethylhexyl diphenyl phosphite
- Diphenyl mono(2-ethylhexyl) phosphite
- Diphenyl(2-ethylhexyl) phosphite
- Doverphos 9EH
- Forstab
- Forstab K 201
- Markphos EHDP
- Mono(2-ethylhexyl) diphenyl phosphite
- Weston EHDP
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | XKZGIJICHCVXFV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C20H27O3P/c1-3-5-12-18(4-2)17-21-24(22-19-13-8-6-9-14-19)23-20-15-10-7-11-16-20/h6-11,13-16,18H,3-5,12,17H2,1-2H3 |
| IUPAC name chemrof:IUPAC_name | Phosphorous Acid, 2-ethylhexyl Diphenyl Ester |
| Molecular formula chemrof:molecular_formula | C20H27O3P |
| Molecular mass chemrof:molecular_mass | 346.407 |
| Monoisotopic mass chemrof:monoisotopic_mass | 346.169781 |
| SMILES string chemrof:smiles_string | CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1 |
Known URLs
6Where else this substance is described. Collected while the pipeline resolved it — from ChEBI's cross-references, from PubChem's identifier list, and from the CAS number — so a link here is a record the merge actually read, not a search it suggests.
| Resource | URL | Recorded by |
|---|---|---|
| CAS Common Chemistry | https://commonchemistry.cas.org/detail?cas_rn=15647-08-2 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.036.090 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID8051752 | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J248.719E | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/85888 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q81984808 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 5729e6cd-84b8-4d6f-b7c5-f8b308990b51 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 2775cb76-2a4b-42e1-97f3-6e7dbf512e5d | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 276aa1eb-8b83-4e7d-ba7d-985cdaaaaeea | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| fe61f637-07c2-4500-8c4c-56e8fd52e030 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 601402bb-6e47-4292-9075-a1ae5d42d47b | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 65827d5d-9925-41ec-8f38-84f3f2cbf424 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| cbc6289f-f047-4c3c-a690-551224845af2 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 13019b81-9ece-4142-b3e6-2a8757a7a214 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 6e34713c-2ff0-4730-9a38-45e166b3b584 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 28b4a2b2-caee-4a7c-8345-a895030740ec | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| a753da1b-2012-4f38-b6a8-ac766e8a451b | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| a808d590-3fc3-4657-a130-c4b550a9943d | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 4189d5c9-a6a4-4497-8f3e-7d6c48c18659 | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-998f93ef159fb420",
"prefLabel": [
{
"@value": "Phosphorous Acid, 2-ethylhexyl Diphenyl Ester",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "bootstrap_labels",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "legacy name field"
}
}
],
"altLabel": [
{
"@value": "2-Ethylhexyl diphenyl phosphite",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diphenyl mono(2-ethylhexyl) phosphite",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diphenyl(2-ethylhexyl) phosphite",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Doverphos 9EH",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Forstab",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Forstab K 201",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Markphos EHDP",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Mono(2-ethylhexyl) diphenyl phosphite",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Weston EHDP",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:15647-08-2",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C20H27O3P"
],
"attested_by": {
"C20H27O3P": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "Molecular formula",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:85888"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"XKZGIJICHCVXFV-UHFFFAOYSA-N"
],
"attested_by": {
"XKZGIJICHCVXFV-UHFFFAOYSA-N": [
"enrich_references.pubchem_semantic",
"rdkit_post_consensus"
]
},
"rdfs:label": "InChIKey",
"provenance": [
{
"prov:wasGeneratedBy": "enrich_references.pubchem_semantic",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:85888"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Phosphorous Acid, 2-ethylhexyl Diphenyl Ester"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1"
]
}
],
"attested_by": {
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/C20H27O3P/c1-3-5-12-18(4-2)17-21-24(22-19-13-8-6-9-14-19)23-20-15-10-7-11-16-20/h6-11,13-16,18H,3-5,12,17H2,1-2H3"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Phosphorous Acid, 2-ethylhexyl Diphenyl Ester"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1"
]
}
],
"attested_by": {
"InChI=1S/C20H27O3P/c1-3-5-12-18(4-2)17-21-24(22-19-13-8-6-9-14-19)23-20-15-10-7-11-16-20/h6-11,13-16,18H,3-5,12,17H2,1-2H3": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"Phosphorous Acid, 2-ethylhexyl Diphenyl Ester"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Phosphorous Acid, 2-ethylhexyl Diphenyl Ester"
]
},
"attested_by": {
"Phosphorous Acid, 2-ethylhexyl Diphenyl Ester": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
346.407
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(OC1=CC=CC=C1)OC2=CC=CC=C2"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1"
]
}
],
"attested_by": {
"346.407": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
},
"https://w3id.org/chemrof/monoisotopic_mass": {
"@id": "https://w3id.org/chemrof/monoisotopic_mass",
"rdfs:label": "Monoisotopic mass",
"@value": [
346.169781
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(OC1=CC=CC=C1)OC2=CC=CC=C2"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CCCCC(CC)COP(Oc1ccccc1)Oc1ccccc1"
]
}
],
"attested_by": {
"346.169781": [
"rdkit_post_consensus",
"rdkit_pre_consensus"
]
},
"http://qudt.org/schema/qudt/hasUnit": "https://vocab.brightway.one/units/unit/GM-PER-MOL"
}
},
"references": [
{
"@id": "http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J248.719E",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:85888;CAS:15647-08-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[15647-08-2]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.036.090",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:85888;CAS:15647-08-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[15647-08-2]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=15647-08-2",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.consensus_cas_link",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"15647-08-2"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID8051752",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:85888;CAS:15647-08-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[15647-08-2]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/85888",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:85888;CAS:15647-08-2"
],
"prov:wasDerivedFrom": "pubchem.by_cas[15647-08-2]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q81984808",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:85888;CAS:15647-08-2"
],
"prov:wasDerivedFrom": "pubchem.identifiers[15647-08-2]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "13019b81-9ece-4142-b3e6-2a8757a7a214",
"seed_source": "EF 3.1",
"semantic_typing": {
"rule": "neutral_molecule",
"reason": "",
"types": [
"https://w3id.org/chemrof/NeutralMolecule"
],
"provenance": {
"prov:wasGeneratedBy": "semantic_typing.classify",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:wasDerivedFrom": "semantic_typing.rule.neutral_molecule"
}
}
},
"classifications": {
"http://semanticscience.org/resource/CHEMINF_000446": {
"@value": [
"15647-08-2"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=15647-08-2"
}
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "cas_numbers"
}
},
"http://semanticscience.org/resource/CHEMINF_000447": {
"@value": [
"239-716-5"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=239-716-5"
],
"provenance": {
"prov:wasGeneratedBy": "hybrid_name_cas_v1",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"EF 3.1"
],
"prov:wasDerivedFrom": "ec_numbers"
}
}
},
"origin_qualifier": null,
"parent_flow_object_id": null,
"parent_intervention_id": null,
"@type": [
"https://w3id.org/chemrof/NeutralMolecule"
]
}
Something wrong here?
- This substance is published under the wrong name
- This is not that chemical
- This record is two substances, or it is a second copy of one
You do not need to run a build or clone anything. Name the record and say what your evidence is; the measurement is done for you. How contributing works