101564-14-1
(1-METHYL-3-PIPERIDYL)METHYL-(1-HYDROXYCYCLOHEXYL)PHENYLACETATE HYDROC HLORIDE
Name(1-METHYL-3-PIPERIDYL)METHYL-(1-HYDROXYCYCLOHEXYL)PHENYLACETATE HYDROC HLORIDE
pro_formulaC21 H31 N O3 . Cl H
1Identification
【Name】
(1-METHYL-3-PIPERIDYL)METHYL-(1-HYDROXYCYCLOHEXYL)PHENYLACETATE HYDROC HLORIDE
【CAS】
【MDL】
MFCD01734458
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C21 H31 N O3 . Cl H
【pro_molWeight】
381.941
【Inchi】
InChI=1S/C21H31NO3.ClH/c1-22-14-8-9-17(15-22)16-25-20(23)19(18-10-4-2-5-11-18)21(24)12-6-3-7-13-21;/h2,4-5,10-11,17,19,24H,3,6-9,12-16H2,1H3;1H
【InChIKey】
InChIKey=ATJXYEBLDLXPKB-UHFFFAOYSA-N
【SMILES】
CN1CCCC(C1)COC(=O)C(c2ccccc2)C3(CCCCC3)O.Cl
【MOL File】
(1-METHYL-3-PIPERIDY….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:1
pro_acceptors:4
XLogP3:4.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
(1-METHYL-3-PIPERIDYL)METHYL-(1-HYDROXYCYCLOHEXYL)PHENYLACETATE HYDROC HLORIDE.cml