954228-08-1
3-(3-TRIFLUOROMETHYL-PHENOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Name3-(3-TRIFLUOROMETHYL-PHENOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
pro_formulaC17 H22 F3 N O3
1Identification
【Name】
3-(3-TRIFLUOROMETHYL-PHENOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
【CAS】
【MDL】
MFCD09862016
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C17 H22 F3 N O3
【pro_molWeight】
345.359
【Inchi】
InChI=1S/C17H22F3NO3/c1-16(2,3)24-15(22)21-9-5-8-14(11-21)23-13-7-4-6-12(10-13)17(18,19)20/h4,6-7,10,14H,5,8-9,11H2,1-3H3
【InChIKey】
InChIKey=RUIJEEAQKYFWIF-UHFFFAOYSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCCC(C1)Oc2cccc(c2)C(F)(F)F
【MOL File】
3-(3-TRIFLUOROMETHYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:4
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
3-(3-TRIFLUOROMETHYL-PHENOXY)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER.cml