CAS 14482-51-0 2-Bromo-3,5-dichloropyridine (HCID 817090)

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Basic information

CAS: 14482-51-0
Standard SMILES: Clc1cnc(Br)c(Cl)c1
InChIKey: QCKPJWDIDCGQRB-UHFFFAOYSA-N
Molecular formula: C5H2BrCl2N
Average molar mass: 226.88 g/mol
Monoisotopic mass: 224.87476652

Names & identifiers

Preferred name: 2-Bromo-3,5-dichloropyridine
IUPAC: 2-bromo-3,5-dichloropyridine
English name: 2-Bromo-3,5-dichloropyridine
Molecular formula: C5H2BrCl2N
Molecular weight: 226.89

Names & synonyms

2-Bromo-3,5-dichloropyridine14482-51-0DTXSID90355733RefChem:256997DTXCID60306792672-535-33,5-Dichloro-2-BromopyridinePyridine, 2-bromo-3,5-dichloro-MFCD002339902-Bromo-3,5-dichloro-pyridine2-bromo-3,5-dichloropyridinSCHEMBL544483

Show more names

2-Bromo-3,5-dichLAKOS BBS-000013655-Dichloro-2-broMopyridine2-BROMO-3,5-DICHLOROPYRIDUNE2-Bromo-3,5-dichloropyridine >3,5-DICHLORO-2-BROMOPYRIDINE 98+%3,5-DICHLOROPYRIDIN-2-YL-BORONIC ACID

SCHEMBL30023642RB1046SBB039005AKOS000267456AB05062AC-9472CS-W007790GS-6730

Database identifiers

CAS: 14482-51-0
PubChem CID: 817090
DTXSID: DTXSID90355733
EC Number: 672-535-3
Nikkaji: J38.528J

Properties

Computed structural properties

XLogP: 3.2
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: 101

Physicochemical properties

Melting point: 40 · 40-42
Boiling point: 243.3 · 243.3±35.0 °C(Predicted)
Density: 1.848 · 1.848±0.06 g/cm3(Predicted)
storage temp.: Inert atmosphere,Room Temperature
pka: -2.37 · -2.37±0.10(Predicted)
form: Solid
color: Pale brown
InChI: InChI=1S/C5H2BrCl2N/c6-5-4(8)1-3(7)2-9-5/h1-2H
InChIKey: QCKPJWDIDCGQRB-UHFFFAOYSA-N
SMILES: C1(Br)=NC=C(Cl)C=C1Cl
CAS DataBase Reference: 14482 · 14482-51-0(CAS DataBase Reference)
UNSPSC Code: 12352200 · 12352200
Symbol(GHS): 6 · GHS06
Signal word: Danger
Hazard statements: 301 · H301-H315-H319-H335
Precautionary statements: 261 · P261-P264-P270-P301+P310-P302+P352-P305+P351+P338

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (25%): 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 4 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (25%)

Safety data

wgk: WGK 3
hs_code: 2933399990
risk_code: 36/37/38-41-37/38-25
Signal word: Danger
Symbol(GHS): GHS06
hazard_code: Xi,T
hazard_note: Irritant
safety_code: 26-45-39
hazard_class: 6.1
Storage Class: 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
target organs: Respiratory system
Hazard statements: H301-H315-H319-H335
Hazard Classifications: Acute Tox. 3 OralEye Irrit. 2Skin Irrit. 2STOT SE 3
Precautionary statements: P261-P264-P270-P301+P310-P302+P352-P305+P351+P338

Chemistry & industry

Applications · 1 item

Uses2-Bromo-3,5-dichloropyridine is used in various fields, including pharmaceuticals, agrochemicals, and materials science. It is an essential intermediate for the synthesis of different chemical compounds, such as fungicides, herbicides, and insecticides.