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Molecule
ID:8640
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
CF₄O₂S
Molecular Mass
152.0681128
Exact Mass
151.95551312
Charge
0
InChI
InChI=1S/CF4O2S/c2-1(3,4)8(5,6)7
InChIKey
SLVAEVYIJHDKRO-UHFFFAOYSA-N
Canonic Smiles
FS(=O)(=O)C(F)(F)F
Isomeric Smiles
C(F)(S(=O)(=O)F)(F)F
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
1.6258441
LogD (pH = 7.4)
1.6258441
Log P
1.6258441
Molar Refractivity
15.9186
Polarizability
7.074642
Polar Surface Area
34.14
Rotatable Bonds
1
Lipinski's Rule of Five
true
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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Bioactivity
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General Information
Calculated Properties
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RDKit
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JChem
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Academic Data
Names and Identifiers
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Synonyms
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IUPAC Traditional name
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IUPAC name
Registration numbers
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CAS Number
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PubChem SID
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PubChem CID
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MDL Number
Properties
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Product Information
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Safety Information
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Physical Property
Related Proteins
Molecular Spectra
Molecule Details
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Apollo Scientific
References
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PubChem Literature
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From Data Sources
Bioactivity
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PubChem BioAssay
Data Source
Commercial Catalog
Apollo Scientific
PC7431
Matrix Scientific
004450
Academic Data
PubChem
67631
Names and Identifiers
Synonyms
Trifluoromethanesulfonyl fluoride
Trifluoromethanesulphonyl fluoride 99%
IUPAC Traditional name
trifluoromethanesulfonyl fluoride
IUPAC name
trifluoromethanesulfonyl fluoride
Registration numbers
CAS Number
335-05-7
PubChem SID
160971947
PubChem CID
67631
MDL Number
MFCD00042402
Properties
Product Information
Purity
98%
Source
Safety Information
MSDS Link
Download link
Source
TSCA Listed
true
Source
Storage Warning
GAS, TOXIC BY INHALATION
Source
Physical Property
Boiling Point
-25°C
Source
Flash Point
none°C
Source
Molecule Details
Apollo Scientific
PC7431
Cylinder - CGA110 connection
References
PubChem Literature
No Data Available
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Bioactivity
PubChem BioAssay