5449-34-3
1-ETHYL-4-HYDROXY-A-PHENYL-4-PIPERIDINEACETIC ACID
Name1-ETHYL-4-HYDROXY-A-PHENYL-4-PIPERIDINEACETIC ACID
1Identification
【Name】
1-ETHYL-4-HYDROXY-A-PHENYL-4-PIPERIDINEACETIC ACID
【CAS】
【MDL】
MFCD20257715
【English Synonyms】
【Formula】
C15 H21 N O3
【MolWeight】
263.335
【Inchi】
InChI=1S/C15H21NO3/c1-12(13-5-3-2-4-6-13)16-9-7-15(19,8-10-16)11-14(17)18/h2-6,12,19H,7-11H2,1H3,(H,17,18)
【InChIKey】
InChIKey=TWJXTYDBYVAGAJ-UHFFFAOYSA-N
【SMILES】
CC(c1ccccc1)N2CCC(CC2)(CC(=O)O)O
【MOL File】
1-ETHYL-4-HYDROXY-A-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:4
XLogP3:-1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-ETHYL-4-HYDROXY-A-PHENYL-4-PIPERIDINEACETIC ACID.cml