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4-[Methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl 2-propenoate

4-[Methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl 2-propenoate structure

CAS No:
68227-99-6
Formula:
C13H14F11NO4S
Chemical Name:
4-[Methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl 2-propenoate
Synonyms:
2-Propenoic acid,4-[methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl ester;2-Propenoic acid,4-[methyl[(undecafluoropentyl)sulfonyl]amino]butyl ester;4-[Methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl 2-propenoate

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4-[Methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl 2-propenoate Basic Attributes

Molecular Weight：

489.30 g/mol

Exact Mass：

489.30

EC Number：

269-395-7

DSSTox ID：

DTXSID3071303

Characteristics

PSA：

72.1 Å²

4-[Methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl 2-propenoate Use and Manufacturing

Manufacturing Info：

2-Propenoic acid, 4-[methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl ester: INACTIVE|S - indicates a substance that is identified in a final Significant New Use Rule.

Use Classification：

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

Computed Properties

Molecular Weight:489.30
XLogP3:4.6
Hydrogen Bond Acceptor Count:16
Rotatable Bond Count:12
Exact Mass:489.04678888
Monoisotopic Mass:489.04678888
Topological Polar Surface Area:72.1
Heavy Atom Count:30
Complexity:728
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 4-[Methyl[(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)sulfonyl]amino]butyl 2-propenoate

Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties
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