trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane

C4H15O3PS — CID 172731349

IUPACtrihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane
SMILESCS(C)(C)(C)=P(O)(O)O
InChIInChI=1S/C4H15O3PS/c1-9(2,3,4)8(5,6)7/h5-7H,1-4H3
InChIKeyHVJIIBYVZFFHPL-UHFFFAOYSA-N
MW174.20 g/mol
LogP-0.15
Rot. Bonds

About trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane

trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane (PubChem CID 172731349) has the molecular formula C4H15O3PS and a molecular weight of 174.20 g/mol. Its IUPAC name is trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane.

Molecular Properties

Compound Nametrihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane
PubChem CID172731349
Molecular FormulaC4H15O3PS
Molecular Weight174.20 g/mol
Exact Mass174.05
IUPAC Nametrihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane
SMILESCS(C)(C)(C)=P(O)(O)O
InChIInChI=1S/C4H15O3PS/c1-9(2,3,4)8(5,6)7/h5-7H,1-4H3
InChIKeyHVJIIBYVZFFHPL-UHFFFAOYSA-N
XLogP-0.15
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Chloro-(dimethyl-lambda4-sulfanylidene)-dihydroxy-lambda5-phosphane
CID 56982330
(Dimethyl-lambda4-sulfanylidene)-dihydroxy-sulfanyl-lambda5-phosphane
CID 57450092
(Dimethyl-lambda4-sulfanylidene)-trihydroxy-lambda5-phosphane
CID 87233442
(Dimethyl-lambda4-sulfanylidene)-trihydroxy-lambda5-phosphane;ZINC
CID 88845450
Sodium;(dimethyl-lambda4-sulfanylidene)-trihydroxy-lambda5-phosphane;hydride
CID 173428951
(Dimethyl-lambda4-sulfanylidene)-dihydroxyphosphanium
CID 88650750

Frequently Asked Questions

What is the IUPAC name of trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane?
The IUPAC name of trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane (CID 172731349) is trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane.
What is the SMILES notation for trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane?
The canonical SMILES for trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane is CS(C)(C)(C)=P(O)(O)O.
What is the InChIKey of trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane?
The InChIKey is HVJIIBYVZFFHPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H15O3PS/c1-9(2,3,4)8(5,6)7/h5-7H,1-4H3.
What are the key properties of trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane?
trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane has a molecular weight of 174.20 g/mol, XLogP of -0.15, 0 rotatable bonds, 3 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trihydroxy-(tetramethyl-λ6-sulfanylidene)-λ5-phosphane is sourced from PubChem (CID 172731349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).