959123-13-8
CYCLOPENTANECARBOXYLIC ACID, 2-[(4'-AMINO[1,1'-BIPHENYL]-4-YL)CARBONYL]-, METHYL ESTER, (1R,2R)-
NameCYCLOPENTANECARBOXYLIC ACID, 2-[(4'-AMINO[1,1'-BIPHENYL]-4-YL)CARBONYL]-, METHYL ESTER, (1R,2R)-
1Identification
【Name】
CYCLOPENTANECARBOXYLIC ACID, 2-[(4'-AMINO[1,1'-BIPHENYL]-4-YL)CARBONYL]-, METHYL ESTER, (1R,2R)-
【CAS】
【MDL】
MFCD11977758
【English Synonyms】
【Formula】
C20 H21 N O3
【MolWeight】
323.39
【Inchi】
InChI=1S/C20H21NO3/c1-24-20(23)18-4-2-3-17(18)19(22)15-7-5-13(6-8-15)14-9-11-16(21)12-10-14/h5-12,17-18H,2-4,21H2,1H3/t17-,18-/m1/s1
【InChIKey】
InChIKey=XOERXLWVJMDHDW-QZTJIDSGSA-N
【SMILES】
COC(=O)[C@@H]1CCC[C@H]1C(=O)c2ccc(cc2)c3ccc(cc3)N
【MOL File】
CYCLOPENTANECARBOXYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:3.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
CYCLOPENTANECARBOXYLIC ACID, 2-[(4'-AMINO[1,1'-BIPHENYL]-4-YL)CARBONYL]-, METHYL ESTER, (1R,2R)-.cml