Ethyl-3-oxo-5-phenylpent-4-enoate

HCID 11053129

Basic information

Standard SMILES
CCOC(=O)CC(=O)/C=C/c1ccccc1
InChIKey
KNUYHVRRBLEIHT-CMDGGOBGSA-N
Molecular formula
C13H14O3
Average molar mass
218.25 g/mol
Monoisotopic mass
218.0942943

Names & identifiers

Preferred name
Ethyl-3-oxo-5-phenylpent-4-enoate
IUPAC
ethyl (E)-3-oxo-5-phenylpent-4-enoate

Names & synonyms

58369-48-5Ethyl-3-oxo-5-phenylpent-4-enoate(4E)-3-Oxo-5-phenyl-4-pentenoic acid ethyl esterethyl (E)-3-oxo-5-phenylpent-4-enoate(E)-Ethyl 3-oxo-5-phenylpent-4-enoate1503-99-7MFCD000875794-Pentenoic acid, 3-oxo-5-phenyl-, ethyl esterEthyl (E)-3-oxo-5-phenyl-pent-4-enoateSCHEMBL3105202KNUYHVRRBLEIHT-CMDGGOBGSA-N(E)-Ethyl3-oxo-5-phenylpent-4-enoate
Show more names
(E)-ethyl-5-phenyl-3-oxopent-4-enoateethyl (4E)-3-oxo-5-phenyl-4-pentenoateF79422

Database identifiers

PubChem CID
11053129
Nikkaji
J1.014.146J、J492.381B

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
16

Related reactions

2 records

Compound notes

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