134826-28-1
4-PIPERIDINOL, 1-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-, BENZOATE (ESTER), HY DROCHLORIDE
Name4-PIPERIDINOL, 1-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-, BENZOATE (ESTER), HY DROCHLORIDE
FormulaC22 H27 N O4 . Cl H
1Identification
【Name】
4-PIPERIDINOL, 1-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-, BENZOATE (ESTER), HY DROCHLORIDE
【CAS】
【MDL】
MFCD01699521
【English Synonyms】
【Formula】
C22 H27 N O4 . Cl H
【MolWeight】
405.919
【Inchi】
InChI=1S/C22H27NO4.ClH/c1-25-20-9-8-17(16-21(20)26-2)10-13-23-14-11-19(12-15-23)27-22(24)18-6-4-3-5-7-18;/h3-9,16,19H,10-15H2,1-2H3;1H
【InChIKey】
InChIKey=LYXUJZCAWIJHME-UHFFFAOYSA-N
【SMILES】
COc1ccc(cc1OC)CCN2CCC(CC2)OC(=O)c3ccccc3.Cl
【MOL File】
4-PIPERIDINOL, 1-(2-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:5
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-PIPERIDINOL, 1-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-, BENZOATE (ESTER), HY DROCHLORIDE.cml