RefChem:1088812

2-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride

Also Known As: AC1Q1SJD|RefChem:1088812|AC1L1PS4|alpha-Cyclopentylmandelic acid 2-(1-methyl-1,2,3,6-tetrahydro-4-pyridyl)ethyl ester HCl|Mandelic acid, alpha-cyclopentyl-, 2-(1-methyl-1,2,3,6-tetrahydro-4-pyridyl)ethyl ester, hydrochloride|2-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenylacetate;chloride|2-(1-methyl-5,6-dihydro-2H-pyridin-4-yl)ethyl 2-cyclopentyl-2-hydroxy- 2-phenyl-acetate chloride|2-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)ethyl2-cyclopentyl-2-hydroxy-2-phenylacetate|MANDELIC ACID, alpha-CYCLOPENTYL-, 2-(1-METHYL-1,2,3,6-TETRAHYDRO-4-PYRIDYL)ETHY|2-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride|2-(1-methyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl)ethyl2-cyclopentyl-2-hydroxy-2-phenylacetate chloride|2-(1-methyl-3,6-dihydro-2h-pyridin-1-ium-4-yl)ethyl 2-cyclopentyl-2-hydroxy-2-phenylacetate chloride|4-(2-{[cyclopentyl(hydroxy)phenylacetyl]oxy}ethyl)-1-methyl-1,2,3,6-tetrahydropyridinium chloride

Molecular Formula	C21H30ClNO3
Molecular Weight	379.1914 g/mol
LogP	-1.15
Topological Polar Surface Area	50.97 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	379.1914
Heavy Atoms	26
Complexity	612.9

Chemical Identifiers

CAS Number	101710-88-7
SMILES	C[NH+]1CCC(=CC1)CCOC(=O)C(C2CCCC2)(C3=CC=CC=C3)O.[Cl-]