957311-17-0
BOC-(R)-GAMMA-(4-TRIFLUOROMETHYL-BENZYL)-L-PROLINE
NameBOC-(R)-GAMMA-(4-TRIFLUOROMETHYL-BENZYL)-L-PROLINE
1Identification
【Name】
BOC-(R)-GAMMA-(4-TRIFLUOROMETHYL-BENZYL)-L-PROLINE
【CAS】
【MDL】
MFCD06659430
【English Synonyms】
【Formula】
C18 H22 F3 N O4
【MolWeight】
373.369
【Inchi】
InChI=1S/C18H22F3NO4/c1-17(2,3)26-16(25)22-10-12(9-14(22)15(23)24)8-11-4-6-13(7-5-11)18(19,20)21/h4-7,12,14H,8-10H2,1-3H3,(H,23,24)/t12-,14+/m1/s1
【InChIKey】
InChIKey=RQLCPQMSGLKHNN-OCCSQVGLSA-N
【SMILES】
CC(C)(C)OC(=O)N1C[C@@H](C[C@H]1C(=O)O)Cc2ccc(cc2)C(F)(F)F
【MOL File】
BOC-(R)-GAMMA-(4-TRI….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)
【WGK Germany】
3
4CML File
BOC-(R)-GAMMA-(4-TRIFLUOROMETHYL-BENZYL)-L-PROLINE.cml