(dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium

C2H8O2PS+ — CID 88650750

IUPAC(dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium
SMILESCS(C)=[P+](O)O
InChIInChI=1S/C2H8O2PS/c1-6(2)5(3)4/h3-4H,1-2H3/q+1
InChIKeyGCLHYOZMNJJWCC-UHFFFAOYSA-N
MW127.12 g/mol
LogP0.08
Rot. Bonds

About (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium

(dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium (PubChem CID 88650750) has the molecular formula C2H8O2PS+ and a molecular weight of 127.12 g/mol. Its IUPAC name is (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium.

Molecular Properties

Compound Name(dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium
PubChem CID88650750
Molecular FormulaC2H8O2PS+
Molecular Weight127.12 g/mol
Exact Mass127.00
IUPAC Name(dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium
SMILESCS(C)=[P+](O)O
InChIInChI=1S/C2H8O2PS/c1-6(2)5(3)4/h3-4H,1-2H3/q+1
InChIKeyGCLHYOZMNJJWCC-UHFFFAOYSA-N
XLogP0.08
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.12
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium?
The IUPAC name of (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium (CID 88650750) is (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium.
What is the SMILES notation for (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium?
The canonical SMILES for (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium is CS(C)=[P+](O)O.
What is the InChIKey of (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium?
The InChIKey is GCLHYOZMNJJWCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8O2PS/c1-6(2)5(3)4/h3-4H,1-2H3/q+1.
What are the key properties of (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium?
(dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium has a molecular weight of 127.12 g/mol, XLogP of 0.08, 0 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (dimethyl-λ4-sulfanylidene)-dihydroxyphosphanium is sourced from PubChem (CID 88650750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).