939757-49-0
1-(3,4-DIMETHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID
Name1-(3,4-DIMETHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
1-(3,4-DIMETHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD09998921
【English Synonyms】
【Formula】
C15 H21 N O2
【MolWeight】
247.336
【Inchi】
InChI=1S/C15H21NO2/c1-11-5-6-13(8-12(11)2)9-16-7-3-4-14(10-16)15(17)18/h5-6,8,14H,3-4,7,9-10H2,1-2H3,(H,17,18)
【InChIKey】
InChIKey=SBKDHDUKYFHGNR-UHFFFAOYSA-N
【SMILES】
Cc1ccc(cc1C)CN2CCCC(C2)C(=O)O
【MOL File】
1-(3,4-DIMETHYLBENZY….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
1-(3,4-DIMETHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID.cml