4H-1,4-Benzoxazin-3-one, 2,3-dihydro-4-(2-diethylaminoethyl)-2,6-dimethyl-, hydrochloride
Basic information
- CAS
57462-66-5- Standard SMILES
CC[NH+](CC)CCN1C(=O)C(C)Oc2ccc(C)cc21.[Cl-]- InChIKey
NAMSOPNNAZYEMZ-UHFFFAOYSA-N- Molecular formula
- C16H25ClN2O2
- Average molar mass
- 312.83 g/mol
- Monoisotopic mass
- 312.1604557
Names & identifiers
- Preferred name
- 4H-1,4-Benzoxazin-3-one, 2,3-dihydro-4-(2-diethylaminoethyl)-2,6-dimethyl-, hydrochloride
- IUPAC
- 2-(2,6-dimethyl-3-oxo-1,4-benzoxazin-4-yl)ethyl-diethylazanium chloride
Names & synonyms
4H-1,4-Benzoxazin-3-one, 2,3-dihydro-4-(2-diethylaminoethyl)-2,6-dimethyl-, hydrochloride57462-66-54H-1,4-Benzoxazin-3-one, 4-(2-diethylaminoethyl)-2,3-dihydro-2,6-dimethyl-, hydrochlorideRefChem:297118
Database identifiers
- CAS
57462-66-5- PubChem CID
- 42314
Properties
Computed structural properties
- Topological polar surface area
- 34 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…