4-(2-Cyano-acetylamino)benzoic acid ethyl ester

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Catalog Number
ACM15029535
Product Name
4-(2-Cyano-acetylamino)benzoic acid ethyl ester
Structure
Structure
CAS
15029-53-5
Category
Heterocyclic Organic Compound
Synonyms
Oprea1_277432, MolPort-000-465-998, STK317950, ZINC03177310, HMS1782P04, ethyl 4-[(cyanoacetyl)amino]benzoate, CID3793293, 15029-53-5
IUPAC Name
ethyl 4-[(2-cyanoacetyl)amino]benzoate
Molecular Weight
232.235280 [g/mol]
Molecular Formula
C12H12N2O3
Canonical SMILES
CCOC(=O)C1=CC=C(C=C1)NC(=O)CC#N
InChI Key
KQSPTNNCXGBAKE-UHFFFAOYSA-N
Boiling Point
470.6ºC at 760mmHg
Flash Point
238.4ºC
Density
1.243g/cm³
Exact Mass
232.08500
H-Bond Acceptor
4
H-Bond Donor
1
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