2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride
Basic information
- CAS
22244-25-3- Standard SMILES
CCCC[NH2+]C(=O)C1CNc2ccccc2O1.[Cl-]- InChIKey
NJXVAEPBUNMXTK-UHFFFAOYSA-N- Molecular formula
- C13H19ClN2O2
- Average molar mass
- 270.75 g/mol
- Monoisotopic mass
- 270.1135055
Names & identifiers
- Preferred name
- 2H-1,4-Benzoxazine-2-carboxamide, 3,4-dihydro-N-butyl-, monohydrochloride
- IUPAC
- butyl(3,4-dihydro-2H-1,4-benzoxazine-2-carbonyl)azanium chloride
Names & synonyms
2H-1,4-BENZOXAZINE-2-CARBOXAMIDE, 3,4-DIHYDRO-N-BUTYL-, MONOHYDROCHLORIDE22244-25-3RefChem:10651443,4-Dihydro-N-butyl-2H-1,4-benzoxazine-2-carboxamide hydrochloride
Database identifiers
- CAS
22244-25-3- PubChem CID
- 31093
Properties
Computed structural properties
- Topological polar surface area
- 54.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 258
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…