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Structure

Ethyl-4-(4-cyanophenyl)-4-oxobutyrate

CAS
25370-40-5
Catalog Number
ACM25370405
Category
Other Products
Molecular Weight
231.25
Molecular Formula
C13H13NO3

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Specification

Synonyms
ETHYL-4-(4-CYANOPHENYL)-4-OXOBUTYRATE
IUPAC Name
ethyl 4-(4-cyanophenyl)-4-oxobutanoate
Canonical SMILES
CCOC(=O)CCC(=O)C1=CC=C(C=C1)C#N
InChI Key
GNGMXDJQYPWFJI-UHFFFAOYSA-N
Boiling Point
396.431ºC at 760 mmHg
Flash Point
173.421ºC
Density
1.163g/cm³
Exact Mass
231.09000
H-Bond Acceptor
4
H-Bond Donor
0
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