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Phosphorodithioic acid, S-hydroxymethyl o,o-dimethyl ester, acetate

HCID 74447
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Basic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
1741-11-3
Standard SMILES
COP(=S)(OC)SCOC(C)=O
InChIKey
NOQSFQMPWUXNPT-UHFFFAOYSA-N
Molecular formula
C5H11O4PS2
Average molar mass
230.2 g/mol
Monoisotopic mass
229.98363817

Names & identifiers

Preferred name
Phosphorodithioic acid, S-hydroxymethyl o,o-dimethyl ester, acetate
IUPAC
dimethoxyphosphinothioylsulfanylmethyl acetate
English name
METHYL (DIMETHOXYPHOSPHINOTHIOYLTHIO)-ACETATE
Molecular formula
C5H11O4PS2
Molecular weight
230.2428

Names & synonyms

1741-11-3Stauffer R-8033Phosphorodithioic acid, S-hydroxymethyl O,O-dimethyl ester, acetateR-8033ENT 27,207S-((Acetyloxy)methyl) O,O-dimethyl phosphorodithioatePhosphorodithioic acid, S-((acetyloxy)methyl) O,O-dimethyl esterPhosphorodithioic acid, S-[(acetyloxy)methyl] O,O-dimethyl esterS-[(Acetyloxy)methyl] O,O-dimethyl phosphorodithioateRefChem:371212622-674-0dimethoxyphosphinothioylsulfanylmethyl acetate
Show more names
[(dimethoxyphosphorothioyl)sulfanyl]methyl acetate((Dimethoxyphosphorothioyl)thio)methyl acetatestarbld0031516DTXSID30938468NS00114296{[dimethoxy(sulfanylidene)-|E?-phosphanyl]sulfanyl}methyl acetate

Database identifiers

CAS
1741-11-3
PubChem CID
74447
DTXSID
DTXSID30938468
Nikkaji
J34.678K

Properties

Computed structural properties

XLogP
1.6
Topological polar surface area
102 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
12
Formal charge
0
Complexity
188

Physicochemical properties

Symbol(GHS)
6 · GHS06
Signal word
Danger
Hazard statements
301 · H301
Precautionary statements
264 · P264-P270-P301+P310-P321-P330-P405-P501

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

Signal word
Danger
Symbol(GHS)
GHS06
Hazard statements
H301
Precautionary statements
P264-P270-P301+P310-P321-P330-P405-P501

Chemistry & industry

Suppliers2 total

西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]
ASDI-INTER[email protected]

Related reactions

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Compound notes

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On this pageBasic informationNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes