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benzyl[(4S)-2-oxo-1,3-oxazolidin-4-yl]acetate

HCID 86657751
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
O=C1N[C@@H](C(Cc2ccccc2)C(=O)[O-])CO1
InChIKey
QXILQADKQDGXGY-QVDQXJPCSA-M
Molecular formula
C12H12NO4-
Average molar mass
234.23 g/mol
Monoisotopic mass
234.07663286

Names & identifiers

Preferred name
benzyl[(4S)-2-oxo-1,3-oxazolidin-4-yl]acetate
IUPAC
2-[(4S)-2-oxo-1,3-oxazolidin-4-yl]-3-phenylpropanoate

Names & synonyms

QXILQADKQDGXGY-QVDQXJPCSA-Mbenzyl[(4S)-2-oxo-1,3-oxazolidin-4-yl]acetate

Database identifiers

PubChem CID
86657751

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
78.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
17
Formal charge
-1
Complexity
293

Related reactions

1 records
New reaction record
HRID 1880515 reaction equation
HRID 1880515As reactantuspto-grants-2012_11

Compound notes

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