← Back to consensus flow objects
Hexanoic Acid, 2-ethyl-, Zinc Salt, Basic
| Flow Object ID | fo-44ac45033ff4291f | ||||
|---|---|---|---|---|---|
| Type | Consensus | ||||
| prefLabel |
|
||||
| CAS Numbers | 85203-81-2 | ||||
| EC Numbers | 286-272-3 | ||||
| Changes Applied | 13 |
Properties
| Predicate | Value |
|---|---|
| InChIKey |
IFNXAMCERSVZCV-UHFFFAOYSA-L
|
| InChI |
InChI=1S/2C8H16O2.Zn/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2
|
| IUPAC name |
zinc bis(2-ethylhexanoate)
|
| Molecular formula |
C16H30O4Zn
|
| SMILES |
CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zn+2]
|
References
- http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J184.404K
- https://chem.echa.europa.eu/100.004.774
- https://commonchemistry.cas.org/detail?cas_rn=85203-81-2
- https://comptox.epa.gov/dashboard/DTXSID5027065
- https://gsrs.ncats.nih.gov/ginas/app/beta/substances/3J848924K5
- https://pubchem.ncbi.nlm.nih.gov/compound/61083
- https://www.wikidata.org/wiki/Q27257289
Linked Elementary Flows
| UUID | Source | Unit | Context | LCIA Factors | Consensus Changes |
|---|---|---|---|---|---|
1a1aad18… |
EF 3.1 | kg | Environmental → Air → Aircraft cruise height | 4 | 1 |
cd835491… |
EF 3.1 | kg | Environmental → Air → Ground level → Rural (<1000 people/square mile) | 0 | 1 |
52e8e6b0… |
EF 3.1 | kg | Environmental → Air → Ground level → Urban (>1000 people/square mile) | 4 | 1 |
1ffd4c3d… |
EF 3.1 | kg | Environmental → Air → High stack, >150 meters | 4 | 1 |
165c7f91… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 1 |
e0e676e4… |
EF 3.1 | kg | Environmental → Air → Unknown | 4 | 1 |
1fc5444e… |
EF 3.1 | kg | Environmental → Ground → Agricultural | 4 | 1 |
111ae29d… |
EF 3.1 | kg | Environmental → Ground → Unknown | 4 | 1 |
68041af5… |
EF 3.1 | kg | Environmental → Water → Ocean | 4 | 1 |
ab9e8ada… |
EF 3.1 | kg | Environmental → Water → Surface water | 4 | 1 |
6ef7dea1… |
EF 3.1 | kg | Environmental → Water → Unknown | 4 | 1 |
▶
Changes Applied
| Elementary Flow | Field | Old Value | New Value | Comment |
|---|---|---|---|---|
111ae29d… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
12885eef… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
165c7f91… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
1a1aad18… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
1fc5444e… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
1ffd4c3d… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
52e8e6b0… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
68041af5… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
6ef7dea1… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
aa151157… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
ab9e8ada… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
cd835491… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
e0e676e4… |
cas_match_labels |
— |
{"85203-81-2":"exactMatch"} |
group_key=hexanoicacid,2-ethyl-,zincsalt,basic||dimension=Environmental > media=Ground > geography=Unknown; group_sources=['ec_inventory']; cas_sources={'85203-81-2': ['ec_inventory']}; assigned CAS labels from group consensus; object_uuid=fo-44ac45033ff4291f: {'85203-81-2': 'exactMatch'} |
Flow Object JSON
{
"flow_object_id": "fo-44ac45033ff4291f",
"prefLabel": [
{
"@value": "Hexanoic Acid, 2-ethyl-, Zinc Salt, Basic",
"@language": "en",
"@lang": "en",
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"EF 3.1"
],
"prov:wasDerivedFrom": "prefLabel"
}
}
],
"altLabel": [],
"properties": {
"https://w3id.org/chemrof/molecular_formula": {
"@id": "https://w3id.org/chemrof/molecular_formula",
"@value": [
"C16H30O4Zn"
],
"rdfs:label": "Molecular formula",
"provenance": {
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],
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}
},
"https://w3id.org/chemrof/inchi2d_key_string": {
"@id": "https://w3id.org/chemrof/inchi2d_key_string",
"@value": [
"IFNXAMCERSVZCV-UHFFFAOYSA-L"
],
"rdfs:label": "InChIKey",
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},
"https://w3id.org/chemrof/smiles_string": {
"@id": "https://w3id.org/chemrof/smiles_string",
"@value": [
"CCCCC(CC)C(=O)[O-].CCCCC(CC)C(=O)[O-].[Zn+2]"
],
"rdfs:label": "SMILES",
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},
"https://w3id.org/chemrof/inchi2d_string": {
"@id": "https://w3id.org/chemrof/inchi2d_string",
"@value": [
"InChI=1S/2C8H16O2.Zn/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+2/p-2"
],
"rdfs:label": "InChI",
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],
"prov:wasDerivedFrom": "pubchem.props.InChI"
}
},
"https://w3id.org/chemrof/IUPAC_name": {
"@id": "https://w3id.org/chemrof/IUPAC_name",
"@value": [
"zinc bis(2-ethylhexanoate)"
],
"rdfs:label": "IUPAC name",
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],
"prov:wasDerivedFrom": "pubchem.identifiers.IUPAC Name"
}
}
},
"references": [
{
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],
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},
{
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},
{
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{
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],
"created_from": {
"resolver": "hybrid_name_cas_v1",
"seed_uuid": "111ae29d-783a-4dcf-8d98-d05fe0349de2",
"seed_source": "EF 3.1"
},
"classifications": {
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},
"origin_qualifier": null,
"parent_flow_object_id": null
}