Basic information
- CAS
77580-74-6- Standard SMILES
CC1N=C(c2ccccc2)OCC1=O- InChIKey
UQCGNDFZPBLKHJ-UHFFFAOYSA-N- Molecular formula
- C11H11NO2
- Average molar mass
- 189.21 g/mol
- Monoisotopic mass
- 189.07897859
Names & identifiers
- Preferred name
- 4H-1,3-Oxazin-5(6H)-one, 4-methyl-2-phenyl-
- IUPAC
- 4-methyl-2-phenyl-4H-1,3-oxazin-5-one
Names & synonyms
4H-1,3-Oxazin-5(6H)-one, 4-methyl-2-phenyl-77580-74-6DTXSID70341134RefChem:297063DTXCID902922154-Methyl-2-phenyl-4H-1,3-oxazin-5(6H)-one5,6-Dihydro-4-methyl-2-phenyl-4H-1,3-oxazin-5-oneUQCGNDFZPBLKHJ-UHFFFAOYSA-N4-Methyl-2-phenyl-4H-1,3-oxazin-5(6H)-one #
Database identifiers
- CAS
77580-74-6- PubChem CID
- 570567
- DTXSID
DTXSID70341134- Nikkaji
- J610.216F
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 254
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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