Basic information
- CAS
67195-75-9- Standard SMILES
COc1ccc2c(=O)c(C)c(C)oc2c1C[NH+]1CCCCC1.[Cl-]- InChIKey
RIJDJEDTORMKNU-UHFFFAOYSA-N- Molecular formula
- C18H24ClNO3
- Average molar mass
- 337.8 g/mol
- Monoisotopic mass
- 337.1444713
Names & identifiers
- Preferred name
- Chromone, 2,3-dimethyl-7-methoxy-8-(piperidinomethyl)-, hydrochloride
- IUPAC
- 7-methoxy-2,3-dimethyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride
Names & synonyms
Chromone, 7-methoxy-2,3-dimethyl-8-(piperidinomethyl)-, hydrochloride4H-1-Benzopyran-4-one, 7-methoxy-2,3-dimethyl-8-(1-piperidinylmethyl)-, hydrochloride2,3-Dimethyl-7-methoxy-8-(piperidinomethyl)chromone hydrochlorideCHROMONE, 2,3-DIMETHYL-7-METHOXY-8-(PIPERIDINOMETHYL)-, HYDROCHLORIDE67195-75-9RefChem:334054
Database identifiers
- CAS
67195-75-9- PubChem CID
- 49476
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…