Dimethyl-1,3,5-triazin-2-amine

HCID 15820

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Basic information

CAS: 1853-90-3
Standard SMILES: Cc1nc(C)nc(N)n1
InChIKey: VQZRXBOTCNWNLM-UHFFFAOYSA-N
Molecular formula: C5H8N4
Average molar mass: 124.14 g/mol

Names & identifiers

Preferred name: Dimethyl-1,3,5-triazin-2-amine
IUPAC: 4,6-dimethyl-1,3,5-triazin-2-amine
English name: 2-AMINO-4,6-DIMETHYL-1,3,5-TRIAZINE
Molecular formula: C5H8N4
Molecular weight: 124.14

Names & synonyms

1853-90-3dimethyl-1,3,5-triazin-2-amineRefChem:588435860-031-84,6-dimethyl-1,3,5-triazin-2-amine2-Amino-4,6-dimethyl-1,3,5-triazine4,6-dimethyl-1,3,5-triazine-2-ylamineSCHEMBL664729CHEMBL2271911VQZRXBOTCNWNLM-UHFFFAOYSA-NMFCD00052756SBB085560

Show more names

2-AMINO-4,6-DIMETHYL-S-TRIAZINE(4,6-dimethyl-s-triazin-2-yl)amine1,3,5-Triazin-2-aMine, 4,6-diMethyl-

STK365305AKOS005443612SB73323MS-21971SY469244[2-Amino-4,6-dimethyl-1,3,5-triazine]1,3,5-Triazine, 2-amino-4,6-dimethyl-DB-081778

Database identifiers

CAS: 1853-90-3
PubChem CID: 15820
ChEMBL: CHEMBL2271911
EC Number: 860-031-8
Nikkaji: J1.147.103J

Properties

Computed structural properties

XLogP: 0.4
Topological polar surface area: 64.7 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 85

Physicochemical properties

Melting point: 171 · 171-173 °C
Boiling point: 356.5 · 356.5±25.0 °C(Predicted)
Density: 1.194 · 1.194±0.06 g/cm3(Predicted)
pka: 3.81 · 3.81±0.10(Predicted)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H319-H302-H335
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 30 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Safety data

Signal word: Warning
Symbol(GHS): GHS07
Hazard statements: H315-H319-H302-H335
Precautionary statements: P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P-P264-P270-P301+P312-P330-P501