(dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane

C2H9O3PS — CID 87233442

IUPAC(dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane
SMILESCS(C)=P(O)(O)O
InChIInChI=1S/C2H9O3PS/c1-7(2)6(3,4)5/h3-5H,1-2H3
InChIKeySEILKZQSRCKZTH-UHFFFAOYSA-N
MW144.13 g/mol
LogP-0.48
Rot. Bonds

About (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane

(dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane (PubChem CID 87233442) has the molecular formula C2H9O3PS and a molecular weight of 144.13 g/mol. Its IUPAC name is (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane.

Molecular Properties

Compound Name(dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane
PubChem CID87233442
Molecular FormulaC2H9O3PS
Molecular Weight144.13 g/mol
Exact Mass144.00
IUPAC Name(dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane
SMILESCS(C)=P(O)(O)O
InChIInChI=1S/C2H9O3PS/c1-7(2)6(3,4)5/h3-5H,1-2H3
InChIKeySEILKZQSRCKZTH-UHFFFAOYSA-N
XLogP-0.48
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.13
LogP ≤ 5-0.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane?
The IUPAC name of (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane (CID 87233442) is (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane.
What is the SMILES notation for (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane?
The canonical SMILES for (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane is CS(C)=P(O)(O)O.
What is the InChIKey of (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane?
The InChIKey is SEILKZQSRCKZTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H9O3PS/c1-7(2)6(3,4)5/h3-5H,1-2H3.
What are the key properties of (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane?
(dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane has a molecular weight of 144.13 g/mol, XLogP of -0.48, 0 rotatable bonds, 3 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (dimethyl-λ4-sulfanylidene)-trihydroxy-λ5-phosphane is sourced from PubChem (CID 87233442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).