2,2-Dimethyl-3-oxo-tetradecanoic acid ethyl ester

HCID 10063293
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Basic information

Standard SMILES
CCCCCCCCCCCC(=O)C(C)(C)C(=O)OCC
InChIKey
HISXMYQKMAWFPK-UHFFFAOYSA-N
Molecular formula
C18H34O3
Average molar mass
298.5 g/mol

Names & identifiers

Preferred name
2,2-Dimethyl-3-oxo-tetradecanoic acid ethyl ester
IUPAC
ethyl 2,2-dimethyl-3-oxotetradecanoate

Names & synonyms

SCHEMBL9316269HISXMYQKMAWFPK-UHFFFAOYSA-N2,2-dimethyl-3-oxo-tetradecanoic acid ethyl ester

Database identifiers

PubChem CID
10063293

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
14
Heavy atoms
21

Related reactions

4 records
New reaction record

Compound notes

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