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4-Fluorobromobenzene

Catalog Number
ACM460004
CAS Number
460-00-4
Product Name
4-Fluorobromobenzene
Structure
Category
Liquid Crystal (LC) Building Blocks
Synonyms
1-bromo-4-fluoro-benzen;1-Fluoro-4-bromobenzene;4-Bromfluorbenzol;4-Fluorbrombenzol;4-Fluoro-1-bromobenzene;4-Fluorophenyl bromide;4-fluorophenylbromide;Benzene, 1-bromo-4-fluoro-
Description
1-bromo-4-fluorobenzene is a colorless liquid. (NTP, 1992)
IUPAC Name
1-bromo-4-fluorobenzene
Molecular Weight
175g/mol
Molecular Formula
C6H4BrF
Canonical SMILES
C1=CC(=CC=C1F)Br
InChI
InChI=1S/C6H4BrF/c7-5-1-3-6(8)4-2-5/h1-4H
InChI Key
AITNMTXHTIIIBB-UHFFFAOYSA-N
Boiling Point
306 °F at 764 mm Hg (NTP, 1992);151.5 °C
Melting Point
18 °F (NTP, 1992);-17.4 °C
Flash Point
140 °F (NTP, 1992)
Density
1.4946 at 68 °F (NTP, 1992)
Complexity
66.9
Covalently-Bonded Unit Count
1
EC Number
207-300-2
Exact Mass
173.94804g/mol
Formal Charge
0
Hazard Statements
Xi,F,Xn,T
Heavy Atom Count
8
Log P
3.08 (LogP)
Monoisotopic Mass
173.94804g/mol
NSC Number
10268;9460
Rotatable Bond Count
0
Safety Description
26-36-37/39-16-45-36/37-7
Supplemental Hazard Statements
H313-H319-H225-H301+H311+H331-H370-H301-H311-H331-H226-H332
UNII
A7ZH69I3KH
UN Number
1993
XLogP3
3.2
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