256332-83-9
ETHYL 2-(DIETHOXYPHOSPHORYL)-3,3,3-TRIFLUORO-2-[(PHENYLSULFONYL)AMINO]PROPANOATE
NameETHYL 2-(DIETHOXYPHOSPHORYL)-3,3,3-TRIFLUORO-2-[(PHENYLSULFONYL)AMINO]PROPANOATE
FormulaC15 H21 F3 N O7 P S
1Identification
【Name】
ETHYL 2-(DIETHOXYPHOSPHORYL)-3,3,3-TRIFLUORO-2-[(PHENYLSULFONYL)AMINO]PROPANOATE
【CAS】
【MDL】
MFCD00829359
【English Synonyms】
【Formula】
C15 H21 F3 N O7 P S
【MolWeight】
447.365
【Inchi】
InChI=1S/C15H21F3NO7PS/c1-4-24-13(20)14(15(16,17)18,27(21,25-5-2)26-6-3)19-28(22,23)12-10-8-7-9-11-12/h7-11,19H,4-6H2,1-3H3
【InChIKey】
InChIKey=LFROJQPAFQLZFK-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C(C(F)(F)F)(NS(=O)(=O)c1ccccc1)P(=O)(OCC)OCC
【MOL File】
ETHYL 2-(DIETHOXYPHO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 2-(DIETHOXYPHOSPHORYL)-3,3,3-TRIFLUORO-2-[(PHENYLSULFONYL)AMINO]PROPANOATE.cml