634466-01-6
4-[3-(TRIFLUOROMETHYL)PHENYL]-4-PIPERIDINECARBOXYLIC ACID METHYL ESTER HYDROCHLORIDE
Name4-[3-(TRIFLUOROMETHYL)PHENYL]-4-PIPERIDINECARBOXYLIC ACID METHYL ESTER HYDROCHLORIDE
FormulaC14 H16 F3 N O2 . Cl H
1Identification
【Name】
4-[3-(TRIFLUOROMETHYL)PHENYL]-4-PIPERIDINECARBOXYLIC ACID METHYL ESTER HYDROCHLORIDE
【CAS】
【MDL】
MFCD11223629
【English Synonyms】
【Formula】
C14 H16 F3 N O2 . Cl H
【MolWeight】
323.74
【Inchi】
InChI=1S/C14H16F3NO2.ClH/c1-20-12(19)13(5-7-18-8-6-13)10-3-2-4-11(9-10)14(15,16)17;/h2-4,9,18H,5-8H2,1H3;1H
【InChIKey】
InChIKey=DLVBCRCJHQIZHA-UHFFFAOYSA-N
【SMILES】
COC(=O)C1(CCNCC1)c2cccc(c2)C(F)(F)F.Cl
【MOL File】
4-[3-(TRIFLUOROMETHY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
4-[3-(TRIFLUOROMETHYL)PHENYL]-4-PIPERIDINECARBOXYLIC ACID METHYL ESTER HYDROCHLORIDE.cml