Basic information
- CAS
21965-10-6- Standard SMILES
CC(=O)N1Cc2ccc(N)cc2CO1- InChIKey
XEIDPXZIMOWYQI-UHFFFAOYSA-N- Molecular formula
- C10H12N2O2
- Average molar mass
- 192.21 g/mol
- Monoisotopic mass
- 192.08987763
Names & identifiers
- Preferred name
- 1H-2,3-Benzoxazine, 3,4-dihydro-3-acetyl-7-amino-
- IUPAC
- 1-(7-amino-1,4-dihydro-2,3-benzoxazin-3-yl)ethanone
- English name
- 3-Acetyl-3,4-dihydro-1H-2,3-benzoxazin-7-amine
- Molecular weight
- 0
Names & synonyms
21965-10-6BRN 11128121H-2,3-BENZOXAZINE, 3,4-DIHYDRO-3-ACETYL-7-AMINO-DTXSID001763753-Acetyl-7-amino-3,4-dihydro-1H-2,3-benzoxazine1H-2,3-Benzoxazine, 3-acetyl-7-amino-3,4-dihydro-RefChem:237269DTXCID30988661-(7-Amino-1,4-dihydro-3H-2,3-benzoxazin-3-yl)ethan-1-one3-Acetyl-3,4-dihydro-1H-2,3-benzoxazin-7-amine
Database identifiers
- CAS
21965-10-6- PubChem CID
- 30877
- DTXSID
DTXSID00176375- Nikkaji
- J41.931A
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 232
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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