Basic information
- Standard SMILES
Cl.OC1(Cc2ccccc2)CNCCOC1- InChIKey
KZNPXQXMZOSTCM-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO2
- Average molar mass
- 243.73 g/mol
Names & identifiers
- Preferred name
- 6-Benzyl-1,4-oxazepan-6-ol hydrochloride
- IUPAC
- 6-benzyl-1,4-oxazepan-6-ol;hydrochloride
Names & synonyms
SCHEMBL3164469KZNPXQXMZOSTCM-UHFFFAOYSA-N6-Benzyl-1,4-oxazepan-6-ol hydrochloride
Database identifiers
- PubChem CID
- 68535150
Properties
Computed structural properties
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 192
Related reactions
2 records
Compound notes
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