1,3-benzenediamine
fo-a0c63884718b5d6a
Identity
- Type
- Molecular complex
- CAS
- 541-69-5
- EC
- 208-790-0
- Origin
- EF 3.1 hybrid_name_cas_v1
- Changes
- 54 across every transformer
Structure
Alternative labels
7- 1,3-Benzenediamine, dihydrochloride
- 1,3-Benzenediamine, hydrochloride (1:2)
- 1,3-Diaminobenzene dihydrochloride
- 1,3-Phenylenediamine dihydrochloride
- m-Phenylenediamine hydrochloride
- m-Phenylenediamine, dihydrochloride
- m-Phenylenediammonium dichloride
Properties
| Property | Value |
|---|---|
| InChI2D key string chemrof:inchi2d_key_string | SVTOYMIYCMHPIV-UHFFFAOYSA-N |
| InChI2D string chemrof:inchi2d_string | InChI=1S/C6H8N2.2ClH/c7-5-2-1-3-6(8)4-5;;/h1-4H,7-8H2;2*1H |
| IUPAC name chemrof:IUPAC_name | 1,3-Benzenediamine, dihydrochloride |
| Molecular formula chemrof:molecular_formula | C6H10Cl2N2 |
| Molecular mass chemrof:molecular_mass | 181.066 |
| Monoisotopic mass chemrof:monoisotopic_mass | 180.022104 |
| SMILES string chemrof:smiles_string | Cl.Cl.Nc1cccc(N)c1 |
Known URLs
7Where 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=541-69-5 | enrich_references.consensus_cas_link |
| chem.echa.europa.eu | https://chem.echa.europa.eu/100.007.992 | enrich_references.pubchem_identifier_url |
| comptox.epa.gov | https://comptox.epa.gov/dashboard/DTXSID4021139 | enrich_references.pubchem_identifier_url |
| ebi.ac.uk | https://www.ebi.ac.uk/chembl/explore/compound/CHEMBL3182234 | enrich_references.pubchem_identifier_url |
| gsrs.ncats.nih.gov | https://gsrs.ncats.nih.gov/ginas/app/beta/substances/SE5RLO93TG | enrich_references.pubchem_identifier_url |
| PubChem | https://pubchem.ncbi.nlm.nih.gov/compound/10941 | enrich_references.pubchem_compound |
| Wikidata | https://www.wikidata.org/wiki/Q27289160 | enrich_references.pubchem_identifier_url |
Elementary flows
13| Flow | Context | Source | Unit | CFs |
|---|---|---|---|---|
| ee97f00c-ec02-4a3d-b4f3-b11ac330da78 | Environmental → Air → Aircraft cruise height | EF 3.1 | kg | 0 |
| ef83568c-1dcf-41c8-8e8e-e858e9ce8c09 | Environmental → Air → Ground level → Urban (>1000 people/square mile) | EF 3.1 | kg | 0 |
| bcfe35cb-6ffe-4951-8f37-3478bfbd8130 | Environmental → Air → Indoor | EF 3.1 | kg | 0 |
| d931883f-f189-47e0-a9fb-4df1b37da4e7 | Environmental → Air → Long-term | EF 3.1 | kg | 0 |
| 5bd6768c-c9f5-4a3f-a05d-2d2d349b1445 | Environmental → Air → Medium stack, <150 meters → Rural (<1000 people/square mile) | EF 3.1 | kg | 0 |
| 3a0708b6-44e1-458e-8702-49da1a099fe8 | Environmental → Air → Unknown | EF 3.1 | kg | 0 |
| eb998f1c-ab52-4255-b859-1fa865848d7a | Environmental → Ground → Agricultural | EF 3.1 | kg | 0 |
| c9fa8940-cd81-4964-b8aa-133098195452 | Environmental → Ground → Non-agricultural | EF 3.1 | kg | 0 |
| 0b0fbc84-3592-47f8-9735-17d3f38fecd8 | Environmental → Ground → Unknown | EF 3.1 | kg | 0 |
| 2009c787-6123-4074-ba32-5934267530bc | Environmental → Water → Long-term | EF 3.1 | kg | 0 |
| 14f562b9-5272-410d-ac82-fec1cbe7f353 | Environmental → Water → Ocean | EF 3.1 | kg | 0 |
| df97302e-534e-4a8d-ae83-9920cd654945 | Environmental → Water → Surface water | EF 3.1 | kg | 0 |
| 064591e0-b497-4575-a0e5-5f71cfa772ac | 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