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Structure

4-Benzoyl-4-(2-cyanoethyl)heptanedinitrile

CAS
5342-96-1
Catalog Number
ACM5342961
Category
Other Products
Molecular Weight
279.3364
Molecular Formula
C17H17N3O

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Specification

Synonyms
Phenacylidynetripropionitrile, Tris(cyanoethyl)acetophenone, Propionitrile, phenacylidynetri-, NSC 3685, ZERO/000208, NSC3685, MolPort-001-758-489, NSC 405546, CID94805, BRN 2144045, NSC405546, ZINC01666966, AI3-16027, BAS 00390214, LS-124953, 4-Benzoyl-4-(2-cyano-ethyl)-heptanedinitrile, Heptanedinitrile, 4-benzoyl-4-(2-cyanoethyl)-, 3-10-00-04131 (Beilstein Handbook Reference), Heptanedinitrile, 4-benzoyl-4-(2-cyanoethyl)- (6CI,9CI), 5342-96-1
IUPAC Name
4-benzoyl-4-(2-cyanoethyl)heptanedinitrile
Canonical SMILES
C1=CC=C(C=C1)C(=O)C(CCC#N)(CCC#N)CCC#N
InChI Key
CJSOIFOTLJQHEY-UHFFFAOYSA-N
Boiling Point
571ºC at 760 mmHg
Flash Point
299.1ºC
Density
1.118g/cm³
Exact Mass
279.13700
H-Bond Acceptor
4
H-Bond Donor
0
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