Dichlorodiphenylstannane
fo-0a6c66cac558d0e8
Identity
- Type
- Neutral molecule
- CAS
- 1135-99-5
- EC
- 214-496-3
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 56 across every transformer
Structure
Alternative labels
7- Dichlorobis(phenyl)tin
- Dichlorodiphenyltin
- Diphenyldichlorotin
- Diphenylstannyl dichloride
- Diphenyltin chloride
- Diphenyltin dichloride
- Stannane, dichlorodiphenyl-
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | ISXUHJXWYNONDI-UHFFFAOYSA-L |
| InChI2D string chemrof:inchi2d_string | InChI=1S/2C6H5.2ClH.Sn/c2*1-2-4-6-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2 |
| IUPAC name chemrof:IUPAC_name | Dichlorodiphenylstannane |
| Molecular formula chemrof:molecular_formula | C12H10Cl2Sn |
| Molecular mass chemrof:molecular_mass | 343.829 |
| Monoisotopic mass chemrof:monoisotopic_mass | 343.91815 |
| SMILES string chemrof:smiles_string | [Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1 |
Known URLs
11Where 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.
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| d41c8ae3-28bb-4c60-a5d0-c99783d3bb0c | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| 74b028d2-c437-4e87-a84f-7ed001ef67f0 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| 02948c13-19cf-4d84-8275-7a2e4ca97f3d | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| b4d42da5-66ac-427a-baf5-32b30692affa | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 7d4a5a93-b674-40ac-9e5e-54c351586dc6 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 873ca386-0aaa-4975-8e06-1bc1136cb3c5 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 582e0334-a369-4f57-bb41-7568e2554328 | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 44d5bd04-6597-4f40-af91-f5a34163e4de | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| b0602ee4-2f2f-4d34-adb4-b44ec1337407 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| dc71528c-6dd9-45ee-b504-3edbba1d0ae3 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 9853504c-0506-4dd3-bf77-c0c0f1958622 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 4d10a422-35ff-4125-b7ce-ae888b9a9045 | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| eac9788b-e0b9-458a-9a43-4db60afd996e | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (56 changes)
Full record
Flow object JSON
{
"flow_object_id": "fo-0a6c66cac558d0e8",
"prefLabel": [
{
"@value": "Dichlorodiphenylstannane",
"@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": "Dichlorobis(phenyl)tin",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:1135-99-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Dichlorodiphenyltin",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:1135-99-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diphenyldichlorotin",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:1135-99-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diphenylstannyl dichloride",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:1135-99-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diphenyltin chloride",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:1135-99-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Diphenyltin dichloride",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:1135-99-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
},
{
"@value": "Stannane, dichlorodiphenyl-",
"@language": "en",
"@lang": "en",
"provenance": {
"prov:wasGeneratedBy": "consensus_match",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CAS:1135-99-5",
"EF 3.1",
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"prov:wasDerivedFrom": "common chemistry CAS lookup"
}
}
],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C12H10Cl2Sn"
],
"attested_by": {
"C12H10Cl2Sn": [
"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:14342",
"CID:11163721",
"CID:101686451"
],
"prov:wasDerivedFrom": "pubchem.props.Molecular Formula"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1"
]
}
]
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"ISXUHJXWYNONDI-UHFFFAOYSA-L"
],
"attested_by": {
"ISXUHJXWYNONDI-UHFFFAOYSA-L": [
"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:14342",
"CID:11163721",
"CID:101686451"
],
"prov:wasDerivedFrom": "pubchem.props.InChIKey"
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1"
]
}
]
},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"rdfs:label": "SMILES",
"@value": [
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Dichlorodiphenylstannane"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1"
]
}
],
"attested_by": {
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"rdfs:label": "InChI",
"@value": [
"InChI=1S/2C6H5.2ClH.Sn/c2*1-2-4-6-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2"
],
"provenance": [
{
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Dichlorodiphenylstannane"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1"
]
}
],
"attested_by": {
"InChI=1S/2C6H5.2ClH.Sn/c2*1-2-4-6-5-3-1;;;/h2*1-5H;2*1H;/q;;;;+2/p-2": [
"opsin_iupac",
"rdkit_post_consensus"
]
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"rdfs:label": "IUPAC name",
"@value": [
"Dichlorodiphenylstannane"
],
"provenance": {
"prov:wasGeneratedBy": "opsin_iupac",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"Dichlorodiphenylstannane"
]
},
"attested_by": {
"Dichlorodiphenylstannane": [
"opsin_iupac"
]
}
},
"https://w3id.org/chemrof/molecular_mass": {
"@id": "https://w3id.org/chemrof/molecular_mass",
"rdfs:label": "Molecular mass",
"@value": [
343.829
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.[Cl-].[Cl-]"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1"
]
}
],
"attested_by": {
"343.829": [
"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": [
343.91815
],
"provenance": [
{
"prov:wasGeneratedBy": "rdkit_pre_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"C1=CC=C(C=C1)[Sn+2]C2=CC=CC=C2.[Cl-].[Cl-]"
]
},
{
"prov:wasGeneratedBy": "rdkit_post_consensus",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"[Cl][Sn]([Cl])([c]1ccccc1)[c]1ccccc1"
]
}
],
"attested_by": {
"343.91815": [
"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=J7.275C",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:101686451;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
},
{
"@id": "https://chem.echa.europa.eu/100.013.179",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:14342;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
},
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=1135-99-5",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11163721;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
},
{
"@id": "https://comptox.epa.gov/dashboard/DTXSID7074458",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:14342;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
},
{
"@id": "https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=405640",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:14342;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
},
{
"@id": "https://gsrs.ncats.nih.gov/ginas/app/beta/substances/0Y7MZ4K0DR",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:14342;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/101686451",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:101686451;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[1135-99-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/11163721",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:11163721;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[1135-99-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/compound/14342",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_compound",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:14342;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.by_cas[1135-99-5]"
}
},
{
"@id": "https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=160244",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:14342;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
},
{
"@id": "https://www.wikidata.org/wiki/Q22668718",
"provenance": {
"prov:wasGeneratedBy": "enrich_references.pubchem_identifier_url",
"prov:wasAttributedTo": "consensus-flow-list",
"prov:hadPrimarySource": [
"CID:14342;CAS:1135-99-5"
],
"prov:wasDerivedFrom": "pubchem.identifiers[1135-99-5]"
}
}
],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "02948c13-19cf-4d84-8275-7a2e4ca97f3d",
"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": [
"1135-99-5"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=1135-99-5"
}
],
"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": [
"214-496-3"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=214-496-3"
],
"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