3-Bromo-2-chloro-5-methylpyridine

HCID 285437CAS 17282-03-0

Substructure search Find similar structures

Basic information

Standard SMILES: Cc1cnc(Cl)c(Br)c1
InChIKey: ISNRJFOYJNIKTN-UHFFFAOYSA-N
Molecular formula: C6H5BrClN
Average molar mass: 206.47 g/mol
Monoisotopic mass: 204.92938894

Names & identifiers

Preferred name: 3-Bromo-2-chloro-5-methylpyridine
IUPAC: 3-bromo-2-chloro-5-methylpyridine
English name: 2-Chloro-3-bromo-5-methylpyridine
Molecular formula: C6H5BrClN
Molecular weight: 206.47

Names & synonyms

3-bromo-2-chloro-5-methylpyridine17282-03-0DTXSID30301315RefChem:93115DTXCID80252449829-658-42-Chloro-3-bromo-5-methylpyridineMFCD018306643-bromo-2-chloro-5-methyl-pyridine3-bromo-2-chloro-5-picolineSCHEMBL761533CS-D0948

Show more names

2-Chloro-3-Bromo-5-PicolinePyridine, 3-bromo-2-chloro-5-methyl-3-Bromo-2-chloro-5-methylpyridine 97%2-Chloro-3-bromo-5-methylpyridine ISO 9001：2015 REACH

NSC 142315AB09970DS-1330AC-24921SY018253EN300-1598225-bromo-6-chloro-3-picoline2-Chloro-3-Bromo-5-Methyl Pyridine

Database identifiers

CAS: 17282-03-0
PubChem CID: 285437
DTXSID: DTXSID30301315
EC Number: 829-658-4

Properties

Computed structural properties

XLogP: 2.9
Topological polar surface area: 12.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 9
Formal charge: 0
Complexity: 99.1

Physicochemical properties

Melting point: 65 · 65-68
Boiling point: 247.5 · 247.5±35.0 °C(Predicted)
Density: 1.624 · 1.624±0.06 g/cm3(Predicted)
storage temp.: Inert atmosphere,Room Temperature
solubility: soluble in Methanol
form: powder to crystal
pka: -0.23 · -0.23±0.10(Predicted)
color: White to Light yellow
CAS DataBase Reference: 17282 · 17282-03-0(CAS DataBase Reference)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302+H312+H332-H315-H319-H335
Precautionary statements: 280 · P280-P301+P312-P361+P364
Hazard Codes: Xi,Xn
Risk Statements: 20 · 20/21/22-36/37/38-41-37/38-22
Safety Statements: 22 · 22-26-36/37/39-39
RIDADR: 2811 · 2811
Hazard Note: Harmful
HazardClass: IRRITANT
PackingGroup: Ⅲ
HS Code: 2933399990 · 2933399990

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, 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 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (50%)

Safety data

ridadr: 2811
hs_code: 2933399990
risk_code: 20/21/22-36/37/38-41-37/38-22
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi,Xn
hazard_note: Harmful
safety_code: 22-26-36/37/39-39
hazard_class: IRRITANT
packing_group: Ⅲ
Hazard statements: H302+H312+H332-H315-H319-H335
Precautionary statements: P280-P301+P312-P361+P364

Chemistry & industry

Applications

Uses3-Bromo-2-chloro-5-methylpyridine is used as a reagent in chemical reactions and as a component of organic synthesis intermediates. It is used in the synthesis of 5-Bromo-6-chloronicotinic acid compounds.