5-Bromo-2-chloropyridine

HCID 2734414CAS 53939-30-3
Substructure searchFind similar structures

Basic information

Standard SMILES
Clc1ccc(Br)cn1
InChIKey
PEAOEIWYQVXZMB-UHFFFAOYSA-N
Molecular formula
C5H3BrClN
Average molar mass
192.44 g/mol
Monoisotopic mass
190.91373888

Names & identifiers

Preferred name
5-Bromo-2-chloropyridine
IUPAC
5-bromo-2-chloropyridine
English name
5-Bromo-2-chloropyridine
Molecular formula
C5H3BrClN
Molecular weight
192.44

Names & synonyms

5-Bromo-2-chloropyridine53939-30-3PEAOEIWYQVXZMB-UHFFFAOYSA-DTXSID80370293RefChem:102119DTXCID60321329700-053-6InChI=1/C5H3BrClN/c6-4-1-2-5(7)8-3-4/h1-3HPEAOEIWYQVXZMB-UHFFFAOYSA-N2-Chloro-5-bromopyridineMFCD013189515-bromo-2-chloro-pyridine
Show more names
N-methyl-1-(pyridin-3-yl)methanamineCL0252-cholro-5-broMopyridine3-Bromo-6-chloropyridine5-Bromo-2-chloro pyridne5-bromo-2-chlorolpyridine2-chloro -5-pyridyl broMidePYRIDINE, 5-BROMO-2-CHLORO-
2-chloro-5-bromo-pyridine2-chloro-5-bromo pyridineSCHEMBL182768orb2940415SCHEMBL7969354SCHEMBL9480525SCHEMBL19209881SCHEMBL31742499

Database identifiers

CAS
53939-30-3
PubChem CID
2734414
DTXSID
DTXSID80370293
EC Number
700-053-6
Nikkaji
J1.147.190K

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
0
Heavy atoms
8

Physicochemical properties

Melting point
65 · 65-69 °C (lit.)
Boiling point
208.1 · 208.1±20.0 °C(Predicted)
Density
1.7783 · 1.7783 (rough estimate)
refractive index
1.54 · 1.5400 (estimate)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
pka
-2.25 · -2.25±0.10(Predicted)

Safety & regulation

GHS classification

GHS Classification · 5 items

This chemical does not meet GHS hazard criteria for 1.3% (1 of 77) of reports.

Warning

H315 (98.7%): 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)

Aggregated GHS information provided per 77 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (98.7%)

Safety data

wgk
3
tsca
T
hs_code
29333990
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications · 1 item

Uses5-Bromo-2-chloropyridine may be used in the preparation of following compounds: Amino-2-chloropyridine via palladium-catalyzed amination. 5-Bromo-2-fluoropyridine via halogen-exchange reaction using anhydrous potassium fluoride.2-Chloro-5-(2,5-dimethoxyphenyl)pyridine via Suzuki coupling with 2,5-dimethoxyphenylboronic acid.

Upstream & downstream products

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海泰矶林实业有限公司02150630626 17717886015 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]

Related reactions

162 records
New reaction record

Linked notes

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