Basic information
- CAS
35782-82-2- Standard SMILES
CC1NC(=O)c2cc(N)ccc2O1- InChIKey
HYPRMQUEBGSBOD-UHFFFAOYSA-N- Molecular formula
- C9H10N2O2
- Average molar mass
- 178.19 g/mol
- Monoisotopic mass
- 178.07422757
Names & identifiers
- Preferred name
- 2H-1,3-Benzoxazin-4(3H)-one, 6-amino-2-methyl-
- IUPAC
- 6-amino-2-methyl-2,3-dihydro-1,3-benzoxazin-4-one
Names & synonyms
35782-82-22H-1,3-BENZOXAZIN-4(3H)-ONE, 6-AMINO-2-METHYL-RefChem:10649926-Amino-2-methyl-2H-1,3-benzoxazin-4(3H)-oneA 3102,3-Dihydro-6-amino-2-methyl-4H-1,3-benzoxazin-4-one4H-1,3-Benzoxazin-4-one, 2,3-dihydro-6-amino-2-methyl-SCHEMBL28523387SCHEMBL29634128DTXSID209571686-Amino-2-methyl-2H-1,3-benzoxazin-4-ol
Database identifiers
- CAS
35782-82-2- PubChem CID
- 37262
- DTXSID
DTXSID20957168- Nikkaji
- J65.943F
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 64.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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