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Structure

3-CHLOROVERATRONITRILE

CAS
90537-30-7
Catalog Number
ACM90537307
Category
Other Products
Molecular Weight
197.62
Molecular Formula
C9H8ClNO2

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Specification

Synonyms
639931_ALDRICH, 3-Chloro-4,5-dimethoxybenzonitrile, MolPort-000-886-692, STK397521, ZINC00365888, CID838329, 90537-30-7
IUPAC Name
3-chloro-4,5-dimethoxybenzonitrile
Canonical SMILES
COC1=C(C(=CC(=C1)C#N)Cl)OC
InChI Key
FYVNQNKFUPQFLQ-UHFFFAOYSA-N
Boiling Point
282.4ºC at 760mmHg
Melting Point
101-105ºC(lit.)
Flash Point
124.6ºC
Density
1.26g/cm³
Exact Mass
197.02400
Hazard Statements
Xi: Irritant;
H-Bond Acceptor
3
H-Bond Donor
0
Safety Description
36/37
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