Basic information
- CAS
1198-31-8- Standard SMILES
Cc1cccc2c1OC(=O)NC2- InChIKey
ACTHHUZPROIBPI-UHFFFAOYSA-N- Molecular formula
- C9H9NO2
- Average molar mass
- 163.17 g/mol
- Monoisotopic mass
- 163.06332853
Names & identifiers
- Preferred name
- 8-Methyl-3,4-dihydro-2H-1,3-benzoxazin-2-one
- IUPAC
- 8-methyl-3,4-dihydro-1,3-benzoxazin-2-one
Names & synonyms
1198-31-88-Methyl-3,4-dihydro-2H-1,3-benzoxazin-2-oneDTXSID70494896
Database identifiers
- CAS
1198-31-8- PubChem CID
- 12372027
- DTXSID
DTXSID70494896
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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