896047-15-7
1-(3-METHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID
Name1-(3-METHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
1-(3-METHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD05170996
【English Synonyms】
【Formula】
C14 H19 N O2
【MolWeight】
233.309
【Inchi】
InChI=1S/C14H19NO2/c1-11-4-2-5-12(8-11)9-15-7-3-6-13(10-15)14(16)17/h2,4-5,8,13H,3,6-7,9-10H2,1H3,(H,16,17)
【InChIKey】
InChIKey=JANXWXFEKJLETQ-UHFFFAOYSA-N
【SMILES】
Cc1cccc(c1)CN2CCCC(C2)C(=O)O
【MOL File】
1-(3-METHYLBENZYL)PI….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-METHYLBENZYL)PIPERIDINE-3-CARBOXYLIC ACID.cml