Chromone, 7-hydroxy-2-methyl-8-piperidinomethyl-, hydrochloride
Basic information
- CAS
67195-89-5- Standard SMILES
Cc1cc(=O)c2ccc(O)c(C[NH+]3CCCCC3)c2o1.[Cl-]- InChIKey
VETLVTOCTLUTRT-UHFFFAOYSA-N- Molecular formula
- C16H20ClNO3
- Average molar mass
- 309.79 g/mol
- Monoisotopic mass
- 309.1131712
Names & identifiers
- Preferred name
- Chromone, 7-hydroxy-2-methyl-8-piperidinomethyl-, hydrochloride
- IUPAC
- 7-hydroxy-2-methyl-8-(piperidin-1-ium-1-ylmethyl)chromen-4-one chloride
Names & synonyms
7-Hydroxy-2-methyl-8-piperidinomethylchromone hydrochloride67195-89-5CHROMONE, 7-HYDROXY-2-METHYL-8-PIPERIDINOMETHYL-, HYDROCHLORIDERefChem:334088
Database identifiers
- CAS
67195-89-5- PubChem CID
- 49504
Properties
Computed structural properties
- Topological polar surface area
- 51 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 401
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Compound notes
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