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3-But-2-enoyl-4-phenyl-1,3-oxazolidin-2-one

HCID 496296
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Basic information

Standard SMILES
CC=CC(=O)N1C(=O)OCC1c1ccccc1
InChIKey
DCVIMWRFFDRWJM-UHFFFAOYSA-N
Molecular formula
C13H13NO3
Average molar mass
231.25 g/mol

Names & identifiers

Preferred name
3-But-2-enoyl-4-phenyl-1,3-oxazolidin-2-one
IUPAC
3-but-2-enoyl-4-phenyl-1,3-oxazolidin-2-one

Names & synonyms

SCHEMBL874439

Database identifiers

PubChem CID
496296

Properties

Computed structural properties

XLogP
2
Topological polar surface area
46.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
17
Formal charge
0
Complexity
332

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Related reactions

2 records
New reaction record
HRID 202013 reaction equation
HRID 202013As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 1213180 reaction equation
HRID 1213180As reactantTraining data from https://doi.org/10.1039/C8SC04228D (5/10)

Compound notes

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