4-Bromopyridine

HCID 14268CAS 1120-87-2

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Basic information

Standard SMILES: Brc1ccncc1
InChIKey: BSDGZUDFPKIYQG-UHFFFAOYSA-N
Molecular formula: C5H4BrN
Average molar mass: 158 g/mol
Monoisotopic mass: 156.95271123

Overview

4-bromopyridine is a monobromopyridine.

Names & identifiers

Preferred name: 4-Bromopyridine
IUPAC: 4-bromopyridine
English name: 4-Bromopyridine
Molecular formula: C5H4BrN
Molecular weight: 158

Names & synonyms

4-BROMOPYRIDINE1120-87-2Pyridine, 4-bromo-4-pyridyl bromideCHEBI:51576EINECS 214-320-5DTXSID1061520RefChem:98223DTXCID3033274214-320-5BSDGZUDFPKIYQG-UHFFFAOYSA-NInChI=1/C5H4BrN/c6-5-1-3-7-4-2-5/h1-4

Show more names

4-bromo-pyridin3-IODOPYRIDINE 71-Bromo-4-azabenzeneTedizolid Impurity 79

4-Bromo-PyridineMFCD00234035CHEMBL325044p-bromopyridine4-bromo pyridineBCP216484-Bromopyridine #SCHEMBL8135

Database identifiers

CAS: 1120-87-2
PubChem CID: 14268
DTXSID: DTXSID1061520
ChEMBL: CHEMBL325044
ChEBI: CHEBI:51576
EC Number: 214-320-5
Nikkaji: J32.654B

Properties

Computed structural properties

XLogP: 1.5
Topological polar surface area: 12.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 1
Rotatable bonds: 0
Heavy atoms: 7
Formal charge: 0
Complexity: 50

Experimental & physicochemical properties

SpringerMaterials PropertiesMolecular structure

LogP1.49

Physicochemical properties

Melting point: 53 · 53-56 °C(lit.)
Boiling point: 183 °C · 183°C (rough estimate)
Density: 1.645 · 1.6450
refractive index: 1.5694 · 1.5694 (estimate)
Flash point: 224 °F · 224 °F
pka: 3.35 · 3.35±0.10(Predicted)
InChI: InChI=1S/C5H4BrN/c6-5-1-3-7-4-2-5/h1-4H
InChIKey: BSDGZUDFPKIYQG-UHFFFAOYSA-N
SMILES: C1=NC=CC(Br)=C1
CAS DataBase Reference: 1120 · 1120-87-2(CAS DataBase Reference)
EPA Substance Registry System: 4 · 4-Bromopyridine (1120-87-2)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P305+P351+P338
Hazard Codes: Xi
Risk Statements: 36 · 36/37/38
Safety Statements: 26 · 26-36
WGK Germany: 3 · 3
TSCA: TSCA listed

Safety & regulation

Safety data

wgk: 3
tsca: TSCA listed
risk_code: 36/37/38
Signal word: Warning
Symbol(GHS): GHS07
hazard_code: Xi
safety_code: 26-36
Hazard statements: H302-H315-H319-H335
Precautionary statements: P261-P305+P351+P338

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationPyridine, 4-bromo-: INACTIVE

Applications

Uses4-Bromopyridine is a heterocyclic organic compound and can be used as an organic intermediate.

Upstream & downstream products

Upstream raw materials

Downstream products

1-(4-Pyridyl)piperazine Paraquat dichloride 4,4'-Dipyridyl sulfide 2-(4-Pyridyl)benzaldehyde Piperidine, 4-(1H-pyrazol-1-yl)- (9CI)1,4-Di(4-pyridyl)benzene 4-Ethynylpyridine 5-Bromo-pyrazolo[1,5-a]pyridine-3-carboxylic acid ethyl ester 4-Bromo-2-pyridinemethanol

Suppliers50 total

Shandong chuangyingchemical Co., Ltd.18853181302 · [email protected]

湖北万得化工有限公司15377098680 15377098680 · [email protected]

武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]

毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]

咸宁深蓝生物医药研发有限公司18171815831 · [email protected]

Additional notes

DefinitionChEBI: 4-bromopyridine is a monobromopyridine.

Related reactions

218 records

New reaction record

HRID 555As reactant750 AstraZeneca ELN dataset

HRID 571As reactant750 AstraZeneca ELN dataset

HRID 572As reactant750 AstraZeneca ELN dataset

HRID 573As reactant750 AstraZeneca ELN dataset

HRID 20074As reactantuspto-grants-2010_06

HRID 20148As reactantuspto-grants-2010_06

HRID 46001As reactantuspto-grants-2013_09

HRID 55000As reactantuspto-grants-1997_04

Linked notes

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