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

C6H8O5P2S2 — CID 87475598

IUPACdihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane
SMILESOP(O)(=S)OP(O)(=S)Oc1ccccc1
InChIInChI=1S/C6H8O5P2S2/c7-12(8,14)11-13(9,15)10-6-4-2-1-3-5-6/h1-5H,(H,9,15)(H2,7,8,14)
InChIKeySGTJJQLPJCLPLL-UHFFFAOYSA-N
MW286.21 g/mol
LogP1.51
Rot. Bonds4

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

dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane (PubChem CID 87475598) has the molecular formula C6H8O5P2S2 and a molecular weight of 286.21 g/mol. Its IUPAC name is dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namedihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane
PubChem CID87475598
Molecular FormulaC6H8O5P2S2
Molecular Weight286.21 g/mol
Exact Mass285.93
IUPAC Namedihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane
SMILESOP(O)(=S)OP(O)(=S)Oc1ccccc1
InChIInChI=1S/C6H8O5P2S2/c7-12(8,14)11-13(9,15)10-6-4-2-1-3-5-6/h1-5H,(H,9,15)(H2,7,8,14)
InChIKeySGTJJQLPJCLPLL-UHFFFAOYSA-N
XLogP1.51
TPSA79.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.21
LogP ≤ 51.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dihydroxy-phenoxy-sulfanylidene-λ5-phosphane;ethene
CID 88776379
diphenoxy-sulfanylidene-sulfido-λ5-phosphane
CID 3553797
4-[hydroxy(phenoxy)phosphinothioyl]oxybenzonitrile
CID 18783591
hydroxy-imino-diphenoxy-λ5-phosphane
CID 57044355
zinc oxido-diphenoxy-sulfanylidene-lambda5-phosphane
CID 18762383
tris(diphenyl hydrogen phosphate);phosphane
CID 172751224
diphenyl hydrogen phosphate;dihydrate
CID 21115845
CID 131875092
CID 131875092
diphenyl hydrogen phosphate;silane
CID 175425543
phenoxy-diphenyl-sulfanylidene-lambda5-phosphane
CID 13410918
methane;phenyl phosphono hydrogen phosphate
CID 88820079
N,N'-bis(diphenoxyphosphinothioyl)ethanedithioamide
CID 141224594

Frequently Asked Questions

What is the IUPAC name of dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
The IUPAC name of dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane (CID 87475598) is dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane.
What is the SMILES notation for dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
The canonical SMILES for dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane is OP(O)(=S)OP(O)(=S)Oc1ccccc1.
What is the InChIKey of dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
The InChIKey is SGTJJQLPJCLPLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O5P2S2/c7-12(8,14)11-13(9,15)10-6-4-2-1-3-5-6/h1-5H,(H,9,15)(H2,7,8,14).
What are the key properties of dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane?
dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane has a molecular weight of 286.21 g/mol, XLogP of 1.51, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy-[hydroxy(phenoxy)phosphinothioyl]oxy-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 87475598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).