Coumarin, 6,7-dihydroxy-4-methyl-8-(piperidinomethyl)-, hydrochloride
6,7-dihydroxy-4-methyl-8-(piperidin-1-ium-1-ylmethyl)chromen-2-one chloride
Also Known As: 6,7-Dihydroxy-4-methyl-8-(piperidinomethyl)coumarin hydrochloride|COUMARIN, 6,7-DIHYDROXY-4-METHYL-8-(PIPERIDINOMETHYL)-, HYDROCHLORIDE|6,7-dihydroxy-4-methyl-8-(piperidin-1-ium-1-ylmethyl)chromen-2-one chloride
CAS: 93027-88-4
| Molecular Formula | C16H20ClNO4 |
|---|---|
| Molecular Weight | 325.1081 g/mol |
| LogP | -1.91458 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 325.1081 |
| Monoisotopic Mass | 325.1081 |
| Heavy Atoms | 22 |
| Complexity | 734.9837 |
Chemical Identifiers
| CAS Number | 93027-88-4 |
|---|---|
| SMILES | CC1=CC(=O)OC2=C(C(=C(C=C12)O)O)C[NH+]3CCCCC3.[Cl-] |
Product Overview
Coumarin, 6,7-dihydroxy-4-methyl-8-(piperidinomethyl)-, hydrochloride (CAS 93027-88-4), with molecular formula C16H20ClNO4 and molecular weight 325.1081 g/mol. IUPAC: 6,7-dihydroxy-4-methyl-8-(piperidin-1-ium-1-ylmethyl)chromen-2-one chloride.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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