3-Cyano-3-ethyl-5-methylhexanoic acid ethyl ester

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Catalog Number
ACM90355263
Product Name
3-Cyano-3-ethyl-5-methylhexanoic acid ethyl ester
Structure
Structure
CAS
90355-26-3
Category
Heterocyclic Organic Compound
Synonyms
3-CYANO-3-ETHYL-5-METHYLHEXANOIC ACID ETHYL ESTER
IUPAC Name
ethyl 3-cyano-3-ethyl-5-methylhexanoate
Molecular Weight
211.30064
Molecular Formula
C12H21NO2
Canonical SMILES
CCC(CC(C)C)(CC(=O)OCC)C#N
InChI Key
UBWWPLQZQRSBFZ-UHFFFAOYSA-N
Boiling Point
293.1ºC at 760 mmHg
Flash Point
134.7ºC
Density
0.952g/cm³
Exact Mass
211.15700
H-Bond Acceptor
3
H-Bond Donor
0
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