5-Bromo-2-fluoropyridine

HCID 2783168CAS 766-11-0
Substructure searchFind similar structures

Basic information

Standard SMILES
Fc1ccc(Br)cn1
InChIKey
MYUQKYGWKHTRPG-UHFFFAOYSA-N
Molecular formula
C5H3BrFN
Average molar mass
175.99 g/mol
Monoisotopic mass
174.94328942

Overview

structure in first source

Names & identifiers

Preferred name
5-Bromo-2-fluoropyridine
IUPAC
5-bromo-2-fluoropyridine
English name
5-Bromo-2-fluoropyridine
Molecular formula
C5H3BrFN
Molecular weight
175.99

Names & synonyms

5-Bromo-2-fluoropyridine766-11-02-Fluoro-5-bromopyridineDTXSID40382478RefChem:102127DTXCID60333503629-380-13-bromo-6-fluoropyridine5-bromo-2-fluoro-pyridinePyridine, 5-bromo-2-fluoro-MFCD018637425-Bromo-2-fluoropyridine, 99%
Show more names
5-Brom-2-fluorpyridin5-BROMO-2-FLUO2-Fluoro-5-bromopyri2-FLUORO-5-BORMOPYRIDINE3-fluoro-5-bromopyridine2-Floro-5-Bromo Pyridine2-FLUORO-5-BROMO PYRIDINE5-Bromo-2-fluoropyridine>
AC-7427CL-0780PB30707EN300-62001Z9770357423-Bromo-6-fluoropyridine; 5-Bromo-2-fluoropyridineBCP22215AM20070047

Database identifiers

CAS
766-11-0
PubChem CID
2783168
DTXSID
DTXSID40382478
UNII
6NT3Z783TZ
EC Number
629-380-1
Nikkaji
J1.309.714C

Properties

Computed structural properties

XLogP
2
Topological polar surface area
12.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
0
Heavy atoms
8

Physicochemical properties

Boiling point
162 · 162-164 °C750 mm Hg(lit.)
Density
1.71 g/mL · 1.71 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.5325(lit.)
Flash point
165 °F · 165 °F
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
solubility
DMSO (Slightly), Methanol (Slightly)

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (11.5%): 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 52 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 CategoriesAcute Tox. 4 (11.5%)

Safety data

PPE
Eyeshields, Gloves, type ABEK (EN14387) respirator filter
wgk
3
ridadr
UN2810
hs_code
29339900
risk_code
36/37/38-22
Signal word
Warning

Chemistry & industry

Applications · 2 items

Description5-Bromo-2-fluoropyridine is a halogenated pyridine that has been used as a molecular scaffold for many Active Pharmaceutical Ingredients (APIs) such as Neuropeptide Y Receptor Y5 Inhibitors, SARS-CoV-2 Major Protease Inhibitors, and Indoleamine-2,3-Dioxygenase-1 Inhibitors in cancer immunotherapy. 5-Bromo-2-fluoropyridine is also an ideal building block for semiconductors, due to its aromaticity and electron deficiency. A host material of 5-(5-(2,4,6-triiso-propylphenyl)pyridin-2-yl)-5H-benzo[d]benzo-[4,5]imidazo[1,2-a]imidazole is synthesized from 5-bromo-2-fluoropyridine for OLED applications.

Uses5-Bromo-2-fluoropyridine is used in the synthesis of heteroaromatic and aniline derivatives of piperidines as potent ligands used for vesicular acetylcholine transport. Also used in the synthesis of benzofurano[3,2-d]pyrimidin-2-one derived inhbitors.

Upstream & downstream products

Suppliers50 total

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [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

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Linked notes

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