dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane

H4O4P2S3 — CID 21328842

IUPACdihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane
SMILESOP(O)(=S)OP(O)(=S)S
InChIInChI=1S/H4O4P2S3/c1-5(2,7)4-6(3,8)9/h(H2,1,2,7)(H2,3,8,9)
InChIKeyNFZLPELKMXUQPG-UHFFFAOYSA-N
MW226.18 g/mol
LogP0.36
Rot. Bonds2

About dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane

dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane (PubChem CID 21328842) has the molecular formula H4O4P2S3 and a molecular weight of 226.18 g/mol. Its IUPAC name is dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namedihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane
PubChem CID21328842
Molecular FormulaH4O4P2S3
Molecular Weight226.18 g/mol
Exact Mass225.87
IUPAC Namedihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane
SMILESOP(O)(=S)OP(O)(=S)S
InChIInChI=1S/H4O4P2S3/c1-5(2,7)4-6(3,8)9/h(H2,1,2,7)(H2,3,8,9)
InChIKeyNFZLPELKMXUQPG-UHFFFAOYSA-N
XLogP0.36
TPSA69.92 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.18
LogP ≤ 50.36
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

bis(dihydroxyphosphinothioyloxy)-hydroxy-sulfanylidene-λ5-phosphane;zinc
CID 174957487
azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane
CID 175740324
azane;dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane
CID 23205543
dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane;phosphane;sulfane
CID 174056165
dihydroxyphosphinothioyl phosphono hydrogen phosphate;diphosphono hydrogen phosphate
CID 173221128
dihydroxyphosphinothioyl phosphono hydrogen phosphate
CID 5289416
dihydroxy-sulfanyl-sulfanylidene-λ5-phosphane;trichloro(sulfanylidene)-λ5-phosphane
CID 173308850
3-[hydroxy(sulfanyl)phosphinothioyl]oxypropan-1-ol
CID 152706719
azane;dihydroxy-methoxy-sulfanylidene-λ5-phosphane
CID 174843642
hydroxy-[hydroxy(methyl)phosphinothioyl]oxy-methyl-sulfanylidene-λ5-phosphane
CID 87476531
azane;hydroxy-prop-2-enoxy-sulfanyl-sulfanylidene-λ5-phosphane
CID 87783945
ethenyl-hydroxy-sulfanyl-sulfanylidene-λ5-phosphane
CID 154162230

Frequently Asked Questions

What is the IUPAC name of dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
The IUPAC name of dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane (CID 21328842) is dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane.
What is the SMILES notation for dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
The canonical SMILES for dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane is OP(O)(=S)OP(O)(=S)S.
What is the InChIKey of dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
The InChIKey is NFZLPELKMXUQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/H4O4P2S3/c1-5(2,7)4-6(3,8)9/h(H2,1,2,7)(H2,3,8,9).
What are the key properties of dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane has a molecular weight of 226.18 g/mol, XLogP of 0.36, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy-[hydroxy(sulfanyl)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 21328842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).