AG00BYD5

3761-42-0 | O,O-Dimethyl O-(3-methyl-4-(methylsulfonyl)phenyl) phosphorothioate

AG00BYD5

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CAS Number	3761-42-0
Catalog Number	AG00BYD5(AGN-PC-0WBNDR)
Chemical Name	O,O-Dimethyl O-(3-methyl-4-(methylsulfonyl)phenyl) phosphorothioate
IUPAC Name	dimethoxy-(3-methyl-4-methylsulfonylphenoxy)-sulfanylidene-λ5-phosphane
InChI	InChI=1S/C10H15O5PS2/c1-8-7-9(15-16(17,13-2)14-3)5-6-10(8)18(4,11)12/h5-7H,1-4H3
InChI Key	ZDHYERRNXRANLI-UHFFFAOYSA-N
MDL Number	MFCD00155407
Molecular Formula	C10H15O5PS2
Molecular Weight	310.3269
SMILES	COP(=S)(OC)Oc1ccc(c(C)c1)S(=O)(=O)C
Synonyms	Fenthion sulfone, Fenthion-sulfone, Fenthione sulfone, 3761-42-0, O,O-Dimethyl O-(4-(methylsulfonyl)-m-tolyl) phosphorothioate, O,O-Dimethyl O-((4-methylthio)-m-tolyl)phosphorothioate sulfone, Phosphorothioic acid, O,O-dimethyl O-[4-(methylsulfonyl)-m-tolyl] ester, Phosphorothioic acid, O,O-dimethyl O-(3-methyl-4-(methylsulfonyl)phenyl) ester, PHOSPHOROTHIOIC ACID, O,O-DIMETHYL O-(4-(METHYLSULFONYL)-m-TOLYL) ESTER, Phosphorothioic acid, O,O-dimethyl O-[3-methyl-4-(methylsulfonyl)phenyl] ester, dimethoxy-(3-methyl-4-methylsulfonylphenoxy)-sulfanylidene-?^{5}-phosphane, AC1L2EEY, DTXSID6041975, ZDHYERRNXRANLI-UHFFFAOYSA-N, AKOS015903360, Phosphorothioic acid, O,O-dimethyl O-(3-methyl-4-(methylsulfonyl)phenyl) ester (9CI), LS-108856, Fenthion-sulfone 100 microg/mL in Ethyl acetate, Fenthion-sulfone, PESTANAL(R), analytical standard, I14-18891, dimethoxy-(3-methyl-4-methylsulfonylphenoxy)-sulfanylidene-, O,O-Dimethyl o-[3-methyl-4-(methylsulfonyl)phenyl] thiophosphate #, m-Cresol, 4-(methylsulfonyl)-, O-ester with O,O-dimethyl phosphorothioate, C10H15O5PS2, CID19578, C10-H15-O5-P-S2,

Complexity	409
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	310.01g/mol
Formal Charge	0
Heavy Atom Count	18
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	310.319g/mol
Monoisotopic Mass	310.01g/mol
Rotatable Bond Count	5
Topological Polar Surface Area	102A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H319-H335
Packing Group	Ⅱ
Precautionary statements	P261-P305+P351+P338
Signal Words	warning
UN Code	UN 1648

Certificate of Analysis

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