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Structure

Benzeneacetonitrile,3-bromo-4-methoxy-

CAS
772-59-8
Catalog Number
ACM772598
Category
Other Products
Molecular Weight
226.07
Molecular Formula
C9H8 Br N O

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Specification

Synonyms
3-Bromo-4-methoxyphenylacetonitrile, 772-59-8, 3-Bromo-4-methoxybenzyl Cyanide, SBB058927, AG-H-08785, 2-(3-bromo-4-methoxyphenyl)acetonitrile, 2-(3-bromo-4-methoxyphenyl)ethanenitrile, ZINC02565991, AC1LAX7K, AC1Q4CDR, ACMC-209p8t, SureCN150589, AC1Q44LV, CTK3J5090, MolPort-001-767-915, ANW-36987, AKOS009156590, MCULE-9870858892, KB-87160, B1455
IUPAC Name
2-(3-bromo-4-methoxyphenyl)acetonitrile
Canonical SMILES
COC1=C(C=C(C=C1)CC#N)Br
InChI Key
OBJKHHRZMIIEOK-UHFFFAOYSA-N
Boiling Point
175-178ºC 6mm
Melting Point
50-53ºC
Flash Point
175-178°C/6mm
Density
1.45g/cm³
Exact Mass
224.97900
Hazard Statements
Xi
H-Bond Acceptor
2
H-Bond Donor
0
Packing Group
III
Safety Description
S22-S36/37
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