959581-21-6
BOC-(R)-GAMMA-(4-METHYL-BENZYL)-L-PROLINE
NameBOC-(R)-GAMMA-(4-METHYL-BENZYL)-L-PROLINE
1Identification
【Name】
BOC-(R)-GAMMA-(4-METHYL-BENZYL)-L-PROLINE
【CAS】
【MDL】
MFCD06659409
【English Synonyms】
【Formula】
C18 H25 N O4
【MolWeight】
319.398
【Inchi】
InChI=1S/C18H25NO4/c1-12-5-7-13(8-6-12)9-14-10-15(16(20)21)19(11-14)17(22)23-18(2,3)4/h5-8,14-15H,9-11H2,1-4H3,(H,20,21)/t14-,15+/m1/s1
【InChIKey】
InChIKey=OMVHMNVKZQEBAU-CABCVRRESA-N
【SMILES】
Cc1ccc(cc1)C[C@@H]2C[C@H](N(C2)C(=O)OC(C)(C)C)C(=O)O
【MOL File】
BOC-(R)-GAMMA-(4-MET….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
BOC-(R)-GAMMA-(4-METHYL-BENZYL)-L-PROLINE.cml