4-[(4-aminophenyl)diazenyl]benzenesulfonic Acid
fo-89441fb34e56f001
Identity
- Type
- Neutral molecule
- CAS
- 104-23-4
- EC
- 203-187-9
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 55 across every transformer
Structure
Alternative labels
16- 4-(4-Aminophenylazo)benzenesulfonate
- 4-(4-Aminophenylazo)benzenesulfonic acid
- 4-(4-Sulfophenylazo)aniline
- 4-(4′-Sulfophenylazo)aniline
- 4-[2-(4-Aminophenyl)diazenyl]-benzenesulfonic acid
- 4-[2-(4-Aminophenyl)diazenyl]benzenesulfonic acid
- 4-Amino-1,1′-azobenzene-4′-sulfonic acid
- 4-Amino-4′-sulfoazobenzene
- 4-Aminoazobenzene-4′-sulfonic acid
- 4′-Aminoazobenzene-4-sulfonic acid
- 4′-Sulfo-4-aminoazobenzene
- Benzenesulfonic acid, 4-[(4-aminophenyl)azo]-
- Benzenesulfonic acid, 4-[2-(4-aminophenyl)diazenyl]-
- Benzenesulfonic acid, p-(p-aminophenylazo)-
- C.I. Food Yellow 6
- p-[(p-Aminophenyl)azo]benzenesulfonic acid
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | PPVRMPPLECDING-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C12H11N3O3S/c13-9-1-3-10(4-2-9)14-15-11-5-7-12(8-6-11)19(16,17)18/h1-8H,13H2,(H,16,17,18) |
| IUPAC name chemrof:IUPAC_name | 4-[(4-aminophenyl)diazenyl]benzenesulfonic Acid |
| Molecular formula chemrof:molecular_formula | C12H11N3O3S |
| Molecular mass chemrof:molecular_mass | 277.305 |
| Monoisotopic mass chemrof:monoisotopic_mass | 277.052112 |
| SMILES string chemrof:smiles_string | Nc1ccc(N=Nc2ccc(S(=O)(=O)O)cc2)cc1 |
Known URLs
8Where 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=104-23-4 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4041731 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=4704 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/G5U4TU950K | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J806K | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/17224 | enrich_references.pubchem_compound |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/substance/?source=niaid&sourceid=019570 | enrich_references.pubchem_identifier_url |
| Wikidata | https://www.wikidata.org/wiki/Q26840855 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| 5397b65b-8704-40c8-82db-f6f5a88fc3c9 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 2 |
| bb7e7044-0c4a-47d0-ab76-f1ea640beb1b | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 2 |
| a84c3370-2c0a-48f3-9c5c-052d090b3675 | Environmental → Air → Indoor | EF 3.1 | kg | 2 |
| 7543cce5-324f-443e-91d2-c9d54c9887f2 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 7b350226-a910-4abe-b13a-a2190a9813d1 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 2 |
| 38d756de-b75c-4b86-abb6-56287e46fbb4 | Environmental → Air → Unknown | EF 3.1 | kg | 2 |
| 828950ff-2387-49d9-92a0-83d2b2c1e58e | Environmental → Ground → Agricultural | EF 3.1 | kg | 2 |
| 0cfb341a-c6ca-4818-8346-90866e02e0bb | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 2 |
| 703b9723-9085-4137-89e1-8eac90417312 | Environmental → Ground → Unknown | EF 3.1 | kg | 2 |
| 50f1dc7d-c3d6-42b6-bfcf-1d0439d68923 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| a39bb3cf-691a-4d58-ab8f-8ec8df197280 | Environmental → Water → Ocean | EF 3.1 | kg | 2 |
| 7c74ef69-67eb-4807-b176-1292d906031b | Environmental → Water → Surface water | EF 3.1 | kg | 2 |
| 405225cb-ed17-4843-ac50-88d65151a8df | Environmental → Water → Unknown | EF 3.1 | kg | 2 |
History
Everything that changed this substance (55 changes)
Full record
Flow object JSON
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"seed_uuid": "0cfb341a-c6ca-4818-8346-90866e02e0bb",
"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": [
"104-23-4"
],
"rdfs:seeAlso": [
"https://commonchemistry.cas.org/detail?cas_rn=104-23-4"
],
"http://www.w3.org/2004/02/skos/core#exactMatch": [
{
"@id": "https://commonchemistry.cas.org/detail?cas_rn=104-23-4"
}
],
"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": [
"203-187-9"
],
"rdfs:seeAlso": [
"https://echa.europa.eu/search-for-chemicals?query=203-187-9"
],
"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