864291-83-8
4-[(2R)-2-(HYDROXYMETHYL)-1-PYRROLIDINYL]-1-PIPERIDINECARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER
Name4-[(2R)-2-(HYDROXYMETHYL)-1-PYRROLIDINYL]-1-PIPERIDINECARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER
1Identification
【Name】
4-[(2R)-2-(HYDROXYMETHYL)-1-PYRROLIDINYL]-1-PIPERIDINECARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER
【CAS】
【MDL】
MFCD12407007
【English Synonyms】
【Formula】
C15 H28 N2 O3
【MolWeight】
284.397
【Inchi】
InChI=1S/C15H28N2O3/c1-15(2,3)20-14(19)16-9-6-12(7-10-16)17-8-4-5-13(17)11-18/h12-13,18H,4-11H2,1-3H3/t13-/m1/s1
【InChIKey】
InChIKey=LLTIITLLPIPADB-CYBMUJFWSA-N
【SMILES】
CC(C)(C)OC(=O)N1CCC(CC1)N2CCC[C@@H]2CO
【MOL File】
4-[(2R)-2-(HYDROXYME….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[(2R)-2-(HYDROXYMETHYL)-1-PYRROLIDINYL]-1-PIPERIDINECARBOXYLIC ACID 1,1-DIMETHYLETHYL ESTER.cml