 Home > Encyclopedia > N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide

N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide

N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide structure

CAS No:
69013-34-9
Formula:
C19H13F19NO7PS
Chemical Name:
N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide
Synonyms:
Benzenesulfonamide,N-methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]-;Benzenesulfonamide,N-methyl-4-[[4,4,5,5,5-pentafluoro-3-(pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-pentenyl]oxy]-N-[2-(phosphonooxy)ethyl]-;N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide

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N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide Basic Attributes

Molecular Weight：

791.3 g/mol

Exact Mass：

791.32

EC Number：

273-785-2

DSSTox ID：

DTXSID1071953

Characteristics

PSA：

122 Å²

N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide Use and Manufacturing

Manufacturing Info：

Benzenesulfonamide, N-methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]-: INACTIVE

Use Classification：

PFAS (per- and polyfluoroalkyl substances) -> OECD Category

Computed Properties

Molecular Weight:791.3
XLogP3:6.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:27
Rotatable Bond Count:11
Exact Mass:790.9846950
Monoisotopic Mass:790.9846950
Topological Polar Surface Area:122
Heavy Atom Count:48
Complexity:1290
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-Methyl-4-[[4,4,5,5,5-pentafluoro-3-(1,1,2,2,2-pentafluoroethyl)-1,2,3-tris(trifluoromethyl)-1-penten-1-yl]oxy]-N-[2-(phosphonooxy)ethyl]benzenesulfonamide

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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