148613-10-9
N-TRIFLUOROACETYL-3-ACETOXY-6-TRIMETHYLSTANNYL-L-PHENYLALANINE ETHYL ESTER
NameN-TRIFLUOROACETYL-3-ACETOXY-6-TRIMETHYLSTANNYL-L-PHENYLALANINE ETHYL ESTER
FormulaC18 H24 F3 N O5 Sn
1Identification
【Name】
N-TRIFLUOROACETYL-3-ACETOXY-6-TRIMETHYLSTANNYL-L-PHENYLALANINE ETHYL ESTER
【CAS】
【MDL】
MFCD02683989
【English Synonyms】
【Formula】
C18 H24 F3 N O5 Sn
【MolWeight】
510.094
【Inchi】
InChI=1S/C15H15F3NO5.3CH3.Sn/c1-3-23-13(21)12(19-14(22)15(16,17)18)8-10-5-4-6-11(7-10)24-9(2)20;;;;/h4,6-7,12H,3,8H2,1-2H3,(H,19,22);3*1H3;/t12-;;;;/m0..../s1
【InChIKey】
InChIKey=YVDNFHPHOLEQQF-KCOFNFEMSA-N
【SMILES】
CCOC(=O)[C@H](Cc1cc(ccc1[Sn](C)(C)C)OC(=O)C)NC(=O)C(F)(F)F
【MOL File】
N-TRIFLUOROACETYL-3-….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
N-TRIFLUOROACETYL-3-ACETOXY-6-TRIMETHYLSTANNYL-L-PHENYLALANINE ETHYL ESTER.cml