885958-11-2
1-BENZYL-4-HYDROXYMETHYL-3-METHYL-PYRROLIDINE-3-CARBOXYLIC ACID
Name1-BENZYL-4-HYDROXYMETHYL-3-METHYL-PYRROLIDINE-3-CARBOXYLIC ACID
1Identification
【Name】
1-BENZYL-4-HYDROXYMETHYL-3-METHYL-PYRROLIDINE-3-CARBOXYLIC ACID
【CAS】
【MDL】
MFCD05662786
【English Synonyms】
【Formula】
C14 H19 N O3
【MolWeight】
249.308
【Inchi】
InChI=1S/C14H19NO3/c1-14(13(17)18)10-15(8-12(14)9-16)7-11-5-3-2-4-6-11/h2-6,12,16H,7-10H2,1H3,(H,17,18)
【InChIKey】
InChIKey=UTMNXWWPFKMQRA-UHFFFAOYSA-N
【SMILES】
CC1(CN(CC1CO)Cc2ccccc2)C(=O)O
【MOL File】
1-BENZYL-4-HYDROXYME….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-BENZYL-4-HYDROXYMETHYL-3-METHYL-PYRROLIDINE-3-CARBOXYLIC ACID.cml