791119-27-2
3-[(4-FLUOROPHENYL)[2-(TRIFLUOROMETHYL)PHENYL]METHOXY]-AZETIDINE HYDROCHLORIDE
Name3-[(4-FLUOROPHENYL)[2-(TRIFLUOROMETHYL)PHENYL]METHOXY]-AZETIDINE HYDROCHLORIDE
FormulaC17 H15 F4 N O . Cl H
1Identification
【Name】
3-[(4-FLUOROPHENYL)[2-(TRIFLUOROMETHYL)PHENYL]METHOXY]-AZETIDINE HYDROCHLORIDE
【CAS】
【MDL】
MFCD11849092
【English Synonyms】
【Formula】
C17 H15 F4 N O . Cl H
【MolWeight】
361.764
【Inchi】
InChI=1S/C17H15F4NO.ClH/c18-12-7-5-11(6-8-12)16(23-13-9-22-10-13)14-3-1-2-4-15(14)17(19,20)21;/h1-8,13,16,22H,9-10H2;1H
【InChIKey】
InChIKey=NDYPSMOJVSYYOA-UHFFFAOYSA-N
【SMILES】
c1ccc(c(c1)C(c2ccc(cc2)F)OC3CNC3)C(F)(F)F.Cl
【MOL File】
3-[(4-FLUOROPHENYL)[….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:2
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3-[(4-FLUOROPHENYL)[2-(TRIFLUOROMETHYL)PHENYL]METHOXY]-AZETIDINE HYDROCHLORIDE.cml