Ethyl 2-chloro-3-oxo-4-phenylbutyrate

HCID 11601176
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Basic information

Standard SMILES
CCOC(=O)C(Cl)C(=O)Cc1ccccc1
InChIKey
RBJYBVPPUKQOQO-UHFFFAOYSA-N
Molecular formula
C12H13ClO3
Average molar mass
240.68 g/mol

Names & identifiers

Preferred name
Ethyl 2-chloro-3-oxo-4-phenylbutyrate
IUPAC
ethyl 2-chloro-3-oxo-4-phenylbutanoate

Names & synonyms

Ethyl 2-chloro-3-oxo-4-phenylbutyrateSCHEMBL3690028RBJYBVPPUKQOQO-UHFFFAOYSA-N

Database identifiers

PubChem CID
11601176
Nikkaji
J2.142.284C

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
43.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
16

Related reactions

4 records
New reaction record

Compound notes

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