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Fenthoxon Sulfoxide

CAT: 0572-TRC-F279015-25MGSize: 25 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-F279015-25MGSize:25 mg
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CAS Number
6552-13-2
Synonyms
Phosphoric acid, dimethyl 3-methyl-4-(methylsulfinyl)phenyl ester; Phosphoric acid, dimethyl 4-(methylsulfinyl)-m-tolyl ester (7CI,8CI); Fenoxon sulfoxide; Fenthion oxon sulfoxide; Fenthion-oxon-sulfoxide
Hazard Statement
Toxic if swallowed; UN number: UN2811; Packing Group: III
Purity
>95% (HPLC)
Smiles
COP(=O)(OC)Oc1ccc(c(C)c1)S(=O)C
Molecular Formula
C10 H15 O5 P S
Molecular Weight
278.2619
InChI
InChI=1S/C10H15O5PS/c1-8-7-9(5-6-10(8)17(4)12)15-16(11,13-2)14-3/h5-7H,1-4H3
Additionnal Information
IUPAC name: dimethyl (3-methyl-4-methylsulfinylphenyl) phosphate
Shipping Conditions
Room Temperature
Storage Conditions
-20°C

Chemical Information

Fenoxon sulfoxide

structure in first source

CAS Number6552-13-2
PubChem CID23047
IUPAC Namedimethyl (3-methyl-4-methylsulfinylphenyl) phosphate
Molecular FormulaC10H15O5PS
Molecular Weight278.26
XLogP1
Topological Polar Surface Area81
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count17
Formal Charge0
Complexity314
SMILES
CC1=C(C=CC(=C1)OP(=O)(OC)OC)S(=O)C
InChI
InChI=1S/C10H15O5PS/c1-8-7-9(5-6-10(8)17(4)12)15-16(11,13-2)14-3/h5-7H,1-4H3
InChIKey
GTZCKTIZOGTWQO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fenoxon sulfoxide
CAS: 6552-13-2
CID: 23047
Formula: C10H15O5PS
MW: 278.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight278.26
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass278.03778175
Monoisotopic Mass278.03778175
Topological Polar Surface Area81 Ų
Heavy Atom Count17
Formal Charge0
Complexity314
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
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TRC-F279010-50MGFenthoxon Sulfone
TRC-F279010-25MGFenthoxon Sulfone
TRC-F278010-1GFenthion Sulfoxide
TRC-F278010-100MGFenthion Sulfoxide
TRC-F279003-25MGFenthoxon (Dimethylphosphate-d6)
TRC-F278012-10MGFenthion Sulfoxide-d6

Alternative Products

CatalogName
276212-01Fenthoxon sulfoxide
450017-01Fenthoxon Sulfoxide (Dimethylphosphate-d6)
sc-396308Fenthoxon
276211-01Fenthoxon sulfone
450014-01Fenthoxon (Dimethylphosphate-d6)
450015-01Fenthoxon (S-Methyl-d3)
450016-01Fenthoxon Sulfone (Dimethylphosphate-d6)
CS-T-87181Terbufos-sulfoxide
CS-T-62757Vamidothion Sulfoxide
CS-T-60523Phorate sulfoxide

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