1260601-15-7
Benzenebutanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2,6-difluoro-, (αR)-
NameBenzenebutanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2,6-difluoro-, (αR)-
1Identification
【Name】
Benzenebutanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2,6-difluoro-, (αR)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C25H21F2NO4
【MolWeight】
437.4353
【Inchi】
InChI=1S/C25H21F2NO4/c26-21-10-5-11-22(27)19(21)12-13-23(24(29)30)28-25(31)32-14-20-17-8-3-1-6-15(17)16-7-2-4-9-18(16)20/h1-11,20,23H,12-14H2,(H,28,31)(H,29,30)/t23-/m1/s1
【InChIKey】
InChIKey=VUPYYWOPDYUKLO-HSZRJFAPSA-N
【SMILES】
C1=CC=CC=2C3=CC=CC=C3C(C12)COC(=O)N[C@@H](C(=O)O)CCC1=C(C=CC=C1F)F
【MOL File】
Benzenebutanoic acid….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
Benzenebutanoic acid, α-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-2,6-difluoro-, (αR)-.cml