AC1MCWH1

ethyl 2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-2-[(4-methylphenyl)sulfonylamino]propanoate

Also Known As: ethyl 2-(diisobutoxyphosphoryl)-3,3,3-trifluoro-2-{[(4-methylphenyl)sulphonyl]amino}propanoate|2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-2-[(4-methylphenyl)sulfonylamino]propanoic acid ethyl ester|ethyl 2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-2-[(4-methylphenyl)sulfonylamino]propanoate|2-(Diisobutoxy-phosphoryl)-3,3,3-trifluoro-2-(toluene-4-sulfonylamino)-propionic acid ethyl ester|(R)-ethyl 2-(diisobutoxyphosphoryl)-3,3,3-trifluoro-2-(4-methylphenylsulfonamido)propanoate|ethyl 2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-2-(4-methylbenzenesulfonamido)propanoate|ethyl 2-[bis(2-methylpropoxy)phosphoryl]-3,3,3-trifluoro-N-[(4-methylphenyl)sulfonyl]alaninate

Molecular Formula	C20H31F3NO7PS
Molecular Weight	517.1511 g/mol
LogP	4.63332
Topological Polar Surface Area	108.0 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	12
Exact Mass	517.1511
Monoisotopic Mass	517.1511
Heavy Atoms	33
Complexity	933.4002

Chemical Identifiers

CAS Number	255872-07-2
SMILES	CCOC(=O)C(C(F)(F)F)(NS(=O)(=O)C1=CC=C(C=C1)C)P(=O)(OCC(C)C)OCC(C)C