1146960-67-9
1-PIPERIDINECARBOXYLIC ACID, 4-[[4-CHLORO-2-(1,1-DIMETHYLETHYL)PHENOXY]METHYL]-, 1,1-DIMETHYLETHYL ESTER
Name1-PIPERIDINECARBOXYLIC ACID, 4-[[4-CHLORO-2-(1,1-DIMETHYLETHYL)PHENOXY]METHYL]-, 1,1-DIMETHYLETHYL ESTER
1Identification
【Name】
1-PIPERIDINECARBOXYLIC ACID, 4-[[4-CHLORO-2-(1,1-DIMETHYLETHYL)PHENOXY]METHYL]-, 1,1-DIMETHYLETHYL ESTER
【CAS】
【MDL】
MFCD18073014
【English Synonyms】
【Formula】
C21 H32 Cl N O3
【MolWeight】
381.941
【Inchi】
InChI=1S/C21H32ClNO3/c1-20(2,3)17-13-16(22)7-8-18(17)25-14-15-9-11-23(12-10-15)19(24)26-21(4,5)6/h7-8,13,15H,9-12,14H2,1-6H3
【InChIKey】
InChIKey=VSQNZDPVJZPKRW-UHFFFAOYSA-N
【SMILES】
CC(C)(C)c1cc(ccc1OCC2CCN(CC2)C(=O)OC(C)(C)C)Cl
【MOL File】
1-PIPERIDINECARBOXYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:4
XLogP3:7.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-PIPERIDINECARBOXYLIC ACID, 4-[[4-CHLORO-2-(1,1-DIMETHYLETHYL)PHENOXY]METHYL]-, 1,1-DIMETHYLETHYL ESTER.cml