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1-Bromo-4-ethylbenzene

Catalog Number
ACM1585075
Product Name
1-Bromo-4-ethylbenzene
Structure
CAS
1585-07-5
Category
Liquid Crystal (LC) Building Blocks
IUPAC Name
1-bromo-4-ethylbenzene
Molecular Weight
185.06g/mol
Molecular Formula
C8H9Br
Canonical SMILES
CCC1=CC=C(C=C1)Br
InChI
InChI=1S/C8H9Br/c1-2-7-3-5-8(9)6-4-7/h3-6H,2H2,1H3
InChI Key
URFPRAHGGBYNPW-UHFFFAOYSA-N
Boiling Point
204.0 °C
Melting Point
-43.5 °C
Complexity
72.6
Covalently-Bonded Unit Count
1
EC Number
216-439-8
Exact Mass
183.98876g/mol
Formal Charge
0
Heavy Atom Count
9
Monoisotopic Mass
183.98876g/mol
NSC Number
60144
Rotatable Bond Count
1
UNII
42LI8TAT6J
Vapor Pressure
0.70 mmHg
XLogP3
3.6
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