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Structure

Methyl 4-chlorocinnamate

CAS
7560-44-3
Catalog Number
ACM7560443
Category
Other Products
Molecular Weight
196.63
Molecular Formula
C10H9ClO2

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Specification

Synonyms
4-Chloromethyl cinnamate
IUPAC Name
Methyl (E)-3-(4-chlorophenyl)prop-2-enoate
Canonical SMILES
COC(=O)C=CC1=CC=C(C=C1)Cl
InChI
InChI=1S/C10H9ClO2/c1-13-10(12)7-4-8-2-5-9(11)6-3-8/h2-7H,1H3/b7-4+
InChI Key
IIBXQGYKZKOORG-QPJJXVBHSA-N
Boiling Point
292.8±15.0 °C
Melting Point
76-77 °C
Density
1.211±0.06 g/cm³
Exact Mass
196.0291072
Isomeric SMILES
COC(=O)/C=C/C1=CC=C(C=C1)Cl
Monoisotopic Mass
196.0291072
Topological Polar Surface Area
26.3 Ų
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