775354-20-6
Benzenebutanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-3-(trifluoromethoxy)-, (betaR)-
NameBenzenebutanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-3-(trifluoromethoxy)-, (betaR)-
1Identification
【Name】
Benzenebutanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-3-(trifluoromethoxy)-, (betaR)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C16H20F3NO5
【MolWeight】
363.3289
【Inchi】
InChI=1S/C16H20F3NO5/c1-15(2,3)25-14(23)20-11(9-13(21)22)7-10-5-4-6-12(8-10)24-16(17,18)19/h4-6,8,11H,7,9H2,1-3H3,(H,20,23)(H,21,22)/t11-/m1/s1
【InChIKey】
InChIKey=XTOGMSWIKOHNKB-LLVKDONJSA-N
【SMILES】
CC(C)(OC(=O)N[C@@H](CC(=O)O)CC1=CC(=CC=C1)OC(F)(F)F)C
【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, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-3-(trifluoromethoxy)-, (betaR)-.cml