Diethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-2-(2-phenylethyl)malonate

HCID 21985802
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Basic information

Standard SMILES
CCOC(=O)C(CCc1ccccc1)(CC(=O)c1ccc(Br)cc1)C(=O)OCC
InChIKey
ZDXVIAQODWQTEN-UHFFFAOYSA-N
Molecular formula
C23H25BrO5
Average molar mass
461.3 g/mol
Monoisotopic mass
460.08854

Names & identifiers

Preferred name
Diethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-2-(2-phenylethyl)malonate
IUPAC
diethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-2-(2-phenylethyl)propanedioate

Names & synonyms

SCHEMBL1748056ZDXVIAQODWQTEN-UHFFFAOYSA-Ndiethyl 2-[2-(4-bromophenyl)-2-oxoethyl]-2-(2-phenylethyl)malonate

Database identifiers

PubChem CID
21985802

Properties

Computed structural properties

XLogP
5
Topological polar surface area
69.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
12
Heavy atoms
29

Related reactions

10 records
New reaction record

Compound notes

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