101564-13-0
(1-METHYL-4-PIPERIDYL)METHYL(1-HYDROXYCYCLOHEXYL)PHENYLACETATE
Name(1-METHYL-4-PIPERIDYL)METHYL(1-HYDROXYCYCLOHEXYL)PHENYLACETATE
1Identification
【Name】
(1-METHYL-4-PIPERIDYL)METHYL(1-HYDROXYCYCLOHEXYL)PHENYLACETATE
【CAS】
【MDL】
MFCD01745654
【English Synonyms】
【Formula】
C21 H31 N O3
【MolWeight】
345.48
【Inchi】
InChI=1S/C21H31NO3/c1-22-14-10-17(11-15-22)16-25-20(23)19(18-8-4-2-5-9-18)21(24)12-6-3-7-13-21/h2,4-5,8-9,17,19,24H,3,6-7,10-16H2,1H3
【InChIKey】
InChIKey=BDEINROOCIBWNG-UHFFFAOYSA-N
【SMILES】
CN1CCC(CC1)COC(=O)C(c2ccccc2)C3(CCCCC3)O
【MOL File】
(1-METHYL-4-PIPERIDY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(1-METHYL-4-PIPERIDYL)METHYL(1-HYDROXYCYCLOHEXYL)PHENYLACETATE.cml