Ethyl 2-cyano-2-methyl-5-oxohexanoate

HCID 10997948
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Basic information

Standard SMILES
CCOC(=O)C(C)(C#N)CCC(C)=O
InChIKey
JLXXVFUSWMKFBL-UHFFFAOYSA-N
Molecular formula
C10H15NO3
Average molar mass
197.23 g/mol

Names & identifiers

Preferred name
Ethyl 2-cyano-2-methyl-5-oxohexanoate
IUPAC
ethyl 2-cyano-2-methyl-5-oxohexanoate

Names & synonyms

ethyl 2-cyano-2-methyl-5-oxohexanoateSCHEMBL7776887JLXXVFUSWMKFBL-UHFFFAOYSA-Nethyl 5-oxo-2-cyano-2-methylhexanoate

Database identifiers

PubChem CID
10997948
Nikkaji
J897.659G

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
67.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
14

Related reactions

2 records
New reaction record

Compound notes

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