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Structure

5-Chloro-3-cyanoindole

CAS
194490-14-7
Catalog Number
ACM194490147
Category
Other Products
Molecular Weight
176.602400 [g/mol]
Molecular Formula
C9H5ClN2

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Specification

Synonyms
5-Chloro-3-cyanoindole, AmbTiC50018, MolPort-000-002-607, ZINC26895388, C50018, 194490-14-7
IUPAC Name
5-chloro-1H-indole-3-carbonitrile
Canonical SMILES
C1=CC2=C(C=C1Cl)C(=CN2)C#N
InChI Key
KQMMMHWMPSFPSP-UHFFFAOYSA-N
Boiling Point
383.8ºC at 760mmHg
Flash Point
185.9ºC
Density
1.41g/cm³
Exact Mass
176.01400
H-Bond Acceptor
1
H-Bond Donor
1
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