hydroxy-dimethoxy-sulfanylidene-λ5-phosphane

C4H14O6P2S2 — CID 158776888

IUPAChydroxy-dimethoxy-sulfanylidene-λ5-phosphane
SMILESCOP(O)(=S)OC.COP(O)(=S)OC
InChIInChI=1S/2C2H7O3PS/c2*1-4-6(3,7)5-2/h2*1-2H3,(H,3,7)
InChIKeyIQORMRDBBRNVHK-UHFFFAOYSA-N
MW284.23 g/mol
LogP0.99
Rot. Bonds4

About hydroxy-dimethoxy-sulfanylidene-λ5-phosphane

hydroxy-dimethoxy-sulfanylidene-λ5-phosphane (PubChem CID 158776888) has the molecular formula C4H14O6P2S2 and a molecular weight of 284.23 g/mol. Its IUPAC name is hydroxy-dimethoxy-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namehydroxy-dimethoxy-sulfanylidene-λ5-phosphane
PubChem CID158776888
Molecular FormulaC4H14O6P2S2
Molecular Weight284.23 g/mol
Exact Mass283.97
IUPAC Namehydroxy-dimethoxy-sulfanylidene-λ5-phosphane
SMILESCOP(O)(=S)OC.COP(O)(=S)OC
InChIInChI=1S/2C2H7O3PS/c2*1-4-6(3,7)5-2/h2*1-2H3,(H,3,7)
InChIKeyIQORMRDBBRNVHK-UHFFFAOYSA-N
XLogP0.99
TPSA77.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.23
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

azane;hydroxy-dimethoxy-sulfanylidene-lambda5-phosphane
CID 14041230
azane;dihydroxy-methoxy-sulfanylidene-λ5-phosphane
CID 174843642
hydroxy-methoxy-(3-methoxypropoxy)-sulfanylidene-λ5-phosphane
CID 58974551
N-[hydroxy(methoxy)phosphinothioyl]methanamine
CID 4155878
12-[hydroxy(methoxy)phosphinothioyl]oxydodecan-1-ol
CID 123445050
hydroxy-methoxy-sulfanylidene-(2,2,2-trichloro-1-methoxyethoxy)-λ5-phosphane
CID 58602247
12-[hydroxy(methoxy)phosphinothioyl]oxy-N-methyldodecan-1-amine
CID 177366148
6-[hydroxy(methoxy)phosphinothioyl]oxy-N-methylhexan-1-amine
CID 177366153
1-[hydroxy(methoxy)phosphinothioyl]oxy-3-[methoxy(sulfido)phosphoryl]oxypropan-2-ol
CID 72556314
dimethoxyphosphinothioyloxy-dimethoxy-sulfanylidene-λ5-phosphane
CID 102579137
carbanylium;methyl dihydrogen phosphate
CID 165007935
hydroxy-[hydroxy(methyl)phosphinothioyl]oxy-methyl-sulfanylidene-λ5-phosphane
CID 87476531

Frequently Asked Questions

What is the IUPAC name of hydroxy-dimethoxy-sulfanylidene-λ5-phosphane?
The IUPAC name of hydroxy-dimethoxy-sulfanylidene-λ5-phosphane (CID 158776888) is hydroxy-dimethoxy-sulfanylidene-λ5-phosphane.
What is the SMILES notation for hydroxy-dimethoxy-sulfanylidene-λ5-phosphane?
The canonical SMILES for hydroxy-dimethoxy-sulfanylidene-λ5-phosphane is COP(O)(=S)OC.COP(O)(=S)OC.
What is the InChIKey of hydroxy-dimethoxy-sulfanylidene-λ5-phosphane?
The InChIKey is IQORMRDBBRNVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H7O3PS/c2*1-4-6(3,7)5-2/h2*1-2H3,(H,3,7).
What are the key properties of hydroxy-dimethoxy-sulfanylidene-λ5-phosphane?
hydroxy-dimethoxy-sulfanylidene-λ5-phosphane has a molecular weight of 284.23 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethoxy-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 158776888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).