1253056-12-0
(S)-Methyl 3-amino-4-(2,4,5-trifluorophenyl)butanoate
Name(S)-Methyl 3-amino-4-(2,4,5-trifluorophenyl)butanoate
1Identification
【Name】
(S)-Methyl 3-amino-4-(2,4,5-trifluorophenyl)butanoate
【CAS】
【MDL】
【English Synonyms】
【Formula】
C11H12F3NO2
【MolWeight】
247.2137
【Inchi】
InChI=1S/C11H12F3NO2/c1-17-11(16)4-7(15)2-6-3-9(13)10(14)5-8(6)12/h3,5,7H,2,4,15H2,1H3/t7-/m0/s1
【InChIKey】
InChIKey=AWFWTEYDIPQVSG-ZETCQYMHSA-N
【SMILES】
N[C@H](CC(=O)OC)CC1=C(C=C(C(=C1)F)F)F
【MOL File】
(S)-Methyl 3-amino-4….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
(S)-Methyl 3-amino-4-(2,4,5-trifluorophenyl)butanoate.cml