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Fenthoxon Sulfone

CAT: 0572-TRC-F279010-100MGSize: 100 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F279010-100MGSize:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
14086-35-2
Synonyms
Phosphoric acid, dimethyl 3-methyl-4-(methylsulfonyl)phenyl ester; Phosphoric acid, dimethyl 4-(methylsulfonyl)-m-tolyl ester (7CI,8CI); m-Cresol, 4-(methylsulfonyl)-, dimethyl phosphate (8CI); Fenoxon sulfone; Fenthion O-analog sulfone; Fenthion oxon sulfone; Fenthion-oxon-sulfone
Hazard Statement
Fatal if swallowed; UN number: UN2811; Packing Group: II
Purity
>95% (HPLC)
Smiles
COP(=O)(OC)Oc1ccc(c(C)c1)S(=O)(=O)C
Molecular Formula
C10 H15 O6 P S
Molecular Weight
294.26
InChI
InChI=1S/C10H15O6PS/c1-8-7-9(16-17(11,14-2)15-3)5-6-10(8)18(4,12)13/h5-7H,1-4H3
Additionnal Information
IUPAC name: dimethyl (3-methyl-4-methylsulfonylphenyl) phosphate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Fenoxon sulfone
CAS Number14086-35-2
PubChem CID26449
IUPAC Namedimethyl (3-methyl-4-methylsulfonylphenyl) phosphate
Molecular FormulaC10H15O6PS
Molecular Weight294.26
XLogP1.1
Topological Polar Surface Area87.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity407
SMILES
CC1=C(C=CC(=C1)OP(=O)(OC)OC)S(=O)(=O)C
InChI
InChI=1S/C10H15O6PS/c1-8-7-9(16-17(11,14-2)15-3)5-6-10(8)18(4,12)13/h5-7H,1-4H3
InChIKey
VUTHWSUXEOILTN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fenoxon sulfone
CAS: 14086-35-2
CID: 26449
Formula: C10H15O6PS
MW: 294.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight294.26
XLogP31.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass294.03269637
Monoisotopic Mass294.03269637
Topological Polar Surface Area87.3 Ų
Heavy Atom Count18
Formal Charge0
Complexity407
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
TRC-F279000-100MGFenthoxon
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TRC-F279015-100MGFenthoxon Sulfoxide
TRC-F279015-25MGFenthoxon Sulfoxide
TRC-F278015-250MGFenthion Sulfone
TRC-F278015-25MGFenthion Sulfone
TRC-F279003-25MGFenthoxon (Dimethylphosphate-d6)
TRC-F278017-1MGFenthion Sulfone-d6

Alternative Products

CatalogName
276211-01Fenthoxon sulfone
450016-01Fenthoxon Sulfone (Dimethylphosphate-d6)
sc-396308Fenthoxon
276212-01Fenthoxon sulfoxide
450014-01Fenthoxon (Dimethylphosphate-d6)
450015-01Fenthoxon (S-Methyl-d3)
450017-01Fenthoxon Sulfoxide (Dimethylphosphate-d6)
RG-A261372-01Phenyl Sulfone; Diphenyl Sulfone
C3453-5Sulindac sulfone
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