Ethyl 4-bromomethylcinnamate

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Catalog Number
ACM60682986
Product Name
Ethyl 4-bromomethylcinnamate
Structure
Structure
CAS
60682-98-6
Category
Bromine Series
Synonyms
3-(4-Brommethyl)-phenylpropenoic acid ethyl ester
IUPAC Name
Ethyl (E)-3-[4-(bromomethyl)phenyl]prop-2-enoate
Molecular Weight
269.13
Molecular Formula
C12H13BrO2
Canonical SMILES
CCOC(=O)C=CC1=CC=C(C=C1)CBr
InChI
InChI=1S/C12H13BrO2/c1-2-15-12(14)8-7-10-3-5-11(9-13)6-4-10/h3-8H,2,9H2,1H3/b8-7+
InChI Key
ZIRVAUOPXCOSFU-BQYQJAHWSA-N
Boiling Point
348 °C
Flash Point
164 °C
Density
1.370 g/mL at 25 °C(lit.)
Exact Mass
268.00989
Isomeric SMILES
CCOC(=O)/C=C/C1=CC=C(C=C1)CBr
Monoisotopic Mass
268.00989
Topological Polar Surface Area
26.3 Ų
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