4,4'-diaminobenzanilide
fo-0f2770f1e886d122
Identity
- Type
- Neutral molecule
- CAS
- 785-30-8
- EC
- 212-321-5
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
8- 4,4′-Diaminobenzanilide
- 4,4′-Diaminodiphenylamide
- 4-Amino-N-(4-aminophenyl)benzamide
- 4-Aminobenzoyl-4′-aminoanilide
- Benzamide, 4-amino-N-(4-aminophenyl)-
- Benzanilide, 4,4′-diamino-
- DABAN
- N-(4-Aminophenyl)-4-aminobenzamide
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | XPAQFJJCWGSXGJ-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C13H13N3O/c14-10-3-1-9(2-4-10)13(17)16-12-7-5-11(15)6-8-12/h1-8H,14-15H2,(H,16,17) |
| IUPAC name chemrof:IUPAC_name | 4,4'-diaminobenzanilide |
| Molecular formula chemrof:molecular_formula | C13H13N3O |
| Molecular mass chemrof:molecular_mass | 227.267 |
| Monoisotopic mass chemrof:monoisotopic_mass | 227.105862 |
| SMILES string chemrof:smiles_string | Nc1ccc(NC(=O)c2ccc(N)cc2)cc1 |
Known URLs
9Where 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=785-30-8 | enrich_references.pubchem_identifier_url |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.011.201 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4020400 | enrich_references.pubchem_identifier_url |
| dtp.cancer.gov | https://dtp.cancer.gov/dtpstandard/servlet/dwindex?searchtype=NSC&outputformat=html&searchlist=37092 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL350416 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/00X4JM89UH | enrich_references.pubchem_identifier_url |
| jglobal.jst.go.jp | http://jglobal.jst.go.jp/en/redirect?Nikkaji_No=J7.093I | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/69917 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27231382 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| ae047960-569b-4b5c-80b9-014300c2e535 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| 92650142-44ce-4079-ba9c-eb2b4d0cead5 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| 11efee9e-5dfa-4b2a-be1d-ddc1ebc95359 | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| 9301e357-14fa-4013-bef2-e1fadab68d8f | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 0d19c521-241e-4673-8e28-ef035b4cace9 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| 4bbcf2d9-48db-4353-acd3-792695e1585b | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| f4d5f67b-5acf-490a-960b-bdce2d818822 | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| a5982ab8-942b-47d2-b900-0692c569a5fc | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| c4bcc5d1-da69-424d-8f5e-c3d6c2841650 | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| fb7e1bd7-0b46-4db4-ace9-ea08b6caa630 | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| e60a313b-66a2-4213-9edc-1149d07df24d | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| ae759894-b26f-44e1-ba6a-e0959027bad9 | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| 44b5496e-7aa6-4caf-b2e8-faba856adb6c | Environmental → Water → Unknown | EF 3.1 | kg | 0 |
History
Everything that changed this substance (54 changes)
Full record
Flow object JSON
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}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