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1,1,1-trifluoro-3-octylsulfanylpropan-2-one

1,1,1-trifluoro-3-octylsulfanylpropan-2-one structure

CAS No:
89820-00-8
Formula:
C11H19F3OS
Chemical Name:
1,1,1-trifluoro-3-octylsulfanylpropan-2-one
Synonyms:
3-octylthio-1,1,1-trifluoro-2-propanone;3-octylthio-1,1,1-trifluoropropan-2-one;3-OTFP;89820-00-8;3-Octylthio-1,1,1-trifluoro-2-propanone;1,1,1-TRIFLUORO-3-(OCTYLTHIO)ACETONE;2-Propanone,1,1,1-trifluoro-3-(octylthio)-;UNII-7OYG5MD7P9;7OYG5MD7P9;CHEMBL89506;3-Octylthio-1,1,1-trifluoropropan-2-one;1,1,1-trifluoro-3-octylsulfanylpropan-2-one;2-Propanone, 1,1,1-trifluoro-3-(octylthio)-;3-Otfp;1,1,1-Trifluoro-3-octylsulfanyl-propan-2-one;OTFP;ACMC-20lqwm;1,1,1-trifluoro-3-(octylsulfanyl)propan-2-one;SCHEMBL4224604;DTXSID40237914;BDBM50371970;ZINC34803731;DB08612;1,1,1-Trifluoro-3-(octylsulfanyl)acetone;1,1,1-Trifluoro-3-(octylsulfanyl)acetone #;Q27097811

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1,1,1-trifluoro-3-octylsulfanylpropan-2-one Basic Attributes

Molecular Weight：

256.33 g/mol

Exact Mass：

256.11087089 g/mol

UNII：

7OYG5MD7P9

DSSTox ID：

DTXSID40237914

Characteristics

PSA：

42.4 Å²

Drug Information

MeSH Entry Terms：

3-octylthio-1,1,1-trifluoro-2-propanone

Computed Properties

Molecular Weight:256.33
XLogP3:5.2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:9
Exact Mass:256.11087089
Monoisotopic Mass:256.11087089
Topological Polar Surface Area:42.4
Heavy Atom Count:16
Complexity:192
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 1,1,1-trifluoro-3-octylsulfanylpropan-2-one

Basic Attributes
Characteristics
Drug Information
Computed Properties

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