611240-54-1
Benzenebutanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4,6-trifluoro-, (betaR)-
NameBenzenebutanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4,6-trifluoro-, (betaR)-
1Identification
【Name】
Benzenebutanoic acid, beta-[[(1,1-dimethylethoxy)carbonyl]amino]-2,4,6-trifluoro-, (betaR)-
【CAS】
【MDL】
【English Synonyms】
【Formula】
C15H18F3NO4
【MolWeight】
333.3029
【Inchi】
InChI=1S/C15H18F3NO4/c1-15(2,3)23-14(22)19-9(7-13(20)21)6-10-11(17)4-8(16)5-12(10)18/h4-5,9H,6-7H2,1-3H3,(H,19,22)(H,20,21)/t9-/m1/s1
【InChIKey】
InChIKey=AZRNVXAYTKKFKZ-SECBINFHSA-N
【SMILES】
CC(C)(OC(=O)N[C@@H](CC(=O)O)CC1=C(C=C(C=C1F)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]-2,4,6-trifluoro-, (betaR)-.cml