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Ethyl 2-cyano-3-methylhept-4-ynoate

HCID 108572
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Basic information

CAS
61791-94-4
Standard SMILES
CCC#CC(C)C(C#N)C(=O)OCC
InChIKey
XIYQGENNNXSWPM-UHFFFAOYSA-N
Molecular formula
C11H15NO2
Average molar mass
193.246 g/mol
Monoisotopic mass
193.11027872

Names & identifiers

Preferred name
Ethyl 2-cyano-3-methylhept-4-ynoate
IUPAC
Ethyl 2-cyano-3-methylhept-4-ynoate
English name
ethyl 2-cyano-3-methylhept-4-ynoate
Molecular formula
C11H15NO2
Molecular weight
193.24

Names & synonyms

ethyl 2-cyano-3-methylhept-4-ynoate2-Cyano-3-methyl-4-heptynoic acid ethyl ester4-Heptynoic acid, 2-cyano-3-methyl-, ethyl ester

Database identifiers

CAS
61791-94-4
PubChem CID
108572
DTXSID
DTXSID20977366
EC Number
263-209-8
Nikkaji
J306.894C

Properties

Physicochemical properties

Boiling point
121 °C · 121 °C(Press: 5 Torr)
Density
1.011 · 1.011±0.06 g/cm3(Predicted)

Related reactions

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