3-Bromo-4-methylpyridin-2-amine

HCID 14418043CAS 40073-38-9

Substructure search Find similar structures

Basic information

Standard SMILES: Cc1ccnc(N)c1Br
InChIKey: PDFCXUVNUUYYOI-UHFFFAOYSA-N
Molecular formula: C6H7BrN2
Average molar mass: 187.04 g/mol
Monoisotopic mass: 185.97926032

Names & identifiers

Preferred name: 3-Bromo-4-methylpyridin-2-amine
IUPAC: 3-bromo-4-methylpyridin-2-amine
English name: 2-AMINO-3-BROMO-4-METHYLPYRIDINE
Molecular formula: C6H7BrN2
Molecular weight: 187.04

Names & synonyms

40073-38-93-bromo-4-methylpyridin-2-amineDTXSID10560029RefChem:498706DTXCID10510807997-051-22-Amino-3-bromo-4-picoline2-Amino-3-bromo-4-methylpyridineMFCD080612973-bromo-4-methyl-2-pyridinamine3-bromo-4-methyl-pyridin-2-amine3-bromo-4-methyl-pyridin-2-ylamine

Show more names

2-AMino-3-broMo-4-Methyopyridine2-Pyridinamine, 3-bromo-4-methyl-3-Bromo-4-methylpyridin-2-ylamine2 - amino 4 - methy 3 - bromo pyridine2-AMINO-3-BROMO-4-METHYLPYRIDINE ISO 9001：2015 REACH

SCHEMBL342510SCHEMBL31555011PDFCXUVNUUYYOI-UHFFFAOYSA-N3-bromo-4-methyl-2-pyridinylamineAKOS005135836AC-5164GS-5651SY103764

Database identifiers

CAS: 40073-38-9
PubChem CID: 14418043
DTXSID: DTXSID10560029
EC Number: 997-051-2

Properties

Computed structural properties

XLogP: 1.6
Topological polar surface area: 38.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 97.1

Physicochemical properties

Boiling point: 255.2 · 255.2±35.0 °C(Predicted)
Density: 1.593 · 1.593±0.06 g/cm3(Predicted)
storage temp.: 2 · 2-8°C(protect from light)
pka: 4.71 · 4.71±0.47(Predicted)
Appearance: Off-white to light yellow Solid
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
HS Code: 2933399990 · 2933399990

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)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.