4-Chloro-6-methyl-1,3,5-triazin-2-amine

HCID 30591CAS 21320-62-7

Substructure search Find similar structures

Basic information

Standard SMILES: Cc1nc(N)nc(Cl)n1
InChIKey: BTBXQZKDOSYRDX-UHFFFAOYSA-N
Molecular formula: C4H5ClN4
Average molar mass: 144.56 g/mol
Monoisotopic mass: 144.02027384

Names & identifiers

Preferred name: 4-Chloro-6-methyl-1,3,5-triazin-2-amine
IUPAC: 4-chloro-6-methyl-1,3,5-triazin-2-amine
English name: 4-Chloro-6-methyl-1,3,5-triazin-2-amine
Molecular formula: C4H5ClN4
Molecular weight: 144.56

Names & synonyms

4-Chloro-6-methyl-1,3,5-triazin-2-amine21320-62-72-Methyl-4-amino-6-chloro-1,3,5-triazineDTXSID70274897RefChem:98494DTXCID40226348817-166-2BTBXQZKDOSYRDX-UHFFFAOYSA-N2-amino-4-chloro-6-methyl-1,3,5-triazineMFCD015667351,3,5-Triazin-2-amine, 4-chloro-6-methyl-2-AMINO-4-CHLORO-6-METHYL-S-TRIAZINE

Show more names

SCHEMBL11254ALBB-018641AKOS006338163SB73389BS-41907SY044944(4-chloro-6-methyl-s-triazin-2-yl)amine2-amino-4-chloro-methyl-1,3,5-triazine

Database identifiers

CAS: 21320-62-7
PubChem CID: 30591
DTXSID: DTXSID70274897
EC Number: 817-166-2
Nikkaji: J1.555.471A

Properties

Computed structural properties

XLogP: 1
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: 98.6

Physicochemical properties

Boiling point: 390.6 · 390.6±25.0 °C(Predicted)
Density: 1.451 · 1.451±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C, stored under nitrogen
pka: 2.95 · 2.95±0.10(Predicted)
Appearance: Light yellow to yellow Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 315 · H315-H335-H319
Precautionary statements: 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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 CategoriesSkin Irrit. 2 (100%)

Safety data

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