864829-88-9
1-PIPERIDINECARBOXYLIC ACID, 3-FLUORO-4-(2-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, (3R,4R)-
Name1-PIPERIDINECARBOXYLIC ACID, 3-FLUORO-4-(2-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, (3R,4R)-
pro_formulaC17 H24 F N O2
1Identification
【Name】
1-PIPERIDINECARBOXYLIC ACID, 3-FLUORO-4-(2-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, (3R,4R)-
【CAS】
【MDL】
MFCD15071907
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C17 H24 F N O2
【pro_molWeight】
293.38
【Inchi】
InChI=1S/C17H24FNO2/c1-12-7-5-6-8-13(12)14-9-10-19(11-15(14)18)16(20)21-17(2,3)4/h5-8,14-15H,9-11H2,1-4H3/t14-,15+/m1/s1
【InChIKey】
InChIKey=ISAIXDNNOVFRGJ-CABCVRRESA-N
【SMILES】
Cc1ccccc1[C@H]2CCN(C[C@@H]2F)C(=O)OC(C)(C)C
【MOL File】
1-PIPERIDINECARBOXYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:3
XLogP3:5.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-PIPERIDINECARBOXYLIC ACID, 3-FLUORO-4-(2-METHYLPHENYL)-, 1,1-DIMETHYLETHYL ESTER, (3R,4R)-.cml