Basic information
- CAS
615-71-4- Standard SMILES
Nc1ccc(N)c(N)c1- InChIKey
JSYBAZQQYCNZJE-UHFFFAOYSA-N- Molecular formula
- C6H9N3
- Average molar mass
- 123.16 g/mol
- Monoisotopic mass
- 123.0796473
Overview
Benzene-1,2,4-triamine is a benzenetriamine.
Names & identifiers
- Preferred name
- 1,2,4-Benzenetriamine
- IUPAC
- benzene-1,2,4-triamine
- English name
- benzene-1,2,4-triyltriamine
- Molecular formula
- C6H9N3
- Molecular weight
- 123.16
Names & synonyms
1,2,4-Triaminobenzene615-71-41,2,4-Benzenetriamine1,3,4-Benzenetriamine1,3,4-TriaminobenzeneGU01ZCH3FLNSC-190394DTXSID70210472RefChem:71527DTXCID70132963210-443-3benzene-1,2,4-triamine
Show more names
EINECS 210-428-1
Benzene-1,2,4-triyltriamineaniline, 2,4-diamino-EINECS 210-443-3NSC 190394BRN 06368361,4-BenzenetriamineUNII-GU01ZCH3FL1,2,4-triamino-benzene
Database identifiers
- CAS
615-71-4- PubChem CID
- 69206
- DTXSID
DTXSID70210472- ChEBI
CHEBI:29148- UNII
- GU01ZCH3FL
- EC Number
- 210-443-3
- Nikkaji
- J3.002C
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 94.3
Physicochemical properties
- Melting point
- 97.3 °C · 97.3°C
- Boiling point
- 219.27 °C · 219.27°C (rough estimate)
- Density
- 1.1097 · 1.1097 (rough estimate)
- refractive index
- 1.5589 · 1.5589 (estimate)
- pka
- 5.85 · 5.85±0.10(Predicted)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 1 ZCH3FL · GU01ZCH3FL
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319
- Precautionary statements
- 264 · P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P333+P317, P337+P317, P362+P364, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319
- Precautionary statements
- P264-P280-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers17 total
广州佳途科技股份有限公司81960175-877 18933936954 · [email protected]
沧州康瑞医药科技有限公司18632776803 · [email protected]
武汉壹加壹生物科技有限公司027-027-16602739303 16602739303 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
沧州念科医药科技有限公司18958645613 15076704415 · [email protected]
南京新瑞医药科技有限公司19850079587 · [email protected]
安泰精细化工技术有限公司18503026267 · [email protected]
沧州恩科医药科技有限公司0317-5296180 15533709196 · [email protected]
上海林栎生物科技有限公司13761635123 · [email protected]
河南威梯希化工科技有限公司0371-53732842 13383863444 · [email protected]
Related reactions
5 records
Compound notes
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