bis(tetramethylphosphanium);sulfate

C8H24O4P2S — CID 87132356

IUPACbis(tetramethylphosphanium);sulfate
SMILESC[P+](C)(C)C.C[P+](C)(C)C.O=S(=O)([O-])[O-]
InChIInChI=1S/2C4H12P.H2O4S/c3*1-5(2,3)4/h2*1-4H3;(H2,1,2,3,4)/q2*+1;/p-2
InChIKeyXQFUVNYJLRTMDN-UHFFFAOYSA-L
MW278.29 g/mol
LogP1.71
Rot. Bonds

About bis(tetramethylphosphanium);sulfate

bis(tetramethylphosphanium);sulfate (PubChem CID 87132356) has the molecular formula C8H24O4P2S and a molecular weight of 278.29 g/mol. Its IUPAC name is bis(tetramethylphosphanium);sulfate.

Molecular Properties

Compound Namebis(tetramethylphosphanium);sulfate
PubChem CID87132356
Molecular FormulaC8H24O4P2S
Molecular Weight278.29 g/mol
Exact Mass278.09
IUPAC Namebis(tetramethylphosphanium);sulfate
SMILESC[P+](C)(C)C.C[P+](C)(C)C.O=S(=O)([O-])[O-]
InChIInChI=1S/2C4H12P.H2O4S/c3*1-5(2,3)4/h2*1-4H3;(H2,1,2,3,4)/q2*+1;/p-2
InChIKeyXQFUVNYJLRTMDN-UHFFFAOYSA-L
XLogP1.71
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.29
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}, {'alert_name': 'sulphate', 'substructure': 'N/A'}

Analyze bis(tetramethylphosphanium);sulfate with MolForge

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

Launch Full Analysis

Related Compounds

Oxidooxysulfonyl sulfate;bis(tetramethylphosphanium)
CID 87388921
Sulfonatooxy sulfate;bis(tetramethylphosphanium)
CID 87388922
Bis(tetramethyl-lambda5-phosphanyl) sulfate
CID 140437991
(Tetramethyl-lambda5-phosphanyl) (tetramethyl-lambda5-phosphanyl)oxy sulfate
CID 141617731
Bis(tetramethylphosphanium);sulfite
CID 146316753
Oxido sulfate;bis(tetramethylphosphanium)
CID 159219465
Bis(tetramethyl-lambda5-phosphanyl) sulfite;dihydrate
CID 167313663
Sulfonato sulfate;bis(tetramethylphosphanium)
CID 174869555

Frequently Asked Questions

What is the IUPAC name of bis(tetramethylphosphanium);sulfate?
The IUPAC name of bis(tetramethylphosphanium);sulfate (CID 87132356) is bis(tetramethylphosphanium);sulfate.
What is the SMILES notation for bis(tetramethylphosphanium);sulfate?
The canonical SMILES for bis(tetramethylphosphanium);sulfate is C[P+](C)(C)C.C[P+](C)(C)C.O=S(=O)([O-])[O-].
What is the InChIKey of bis(tetramethylphosphanium);sulfate?
The InChIKey is XQFUVNYJLRTMDN-UHFFFAOYSA-L. The full InChI is InChI=1S/2C4H12P.H2O4S/c3*1-5(2,3)4/h2*1-4H3;(H2,1,2,3,4)/q2*+1;/p-2.
What are the key properties of bis(tetramethylphosphanium);sulfate?
bis(tetramethylphosphanium);sulfate has a molecular weight of 278.29 g/mol, XLogP of 1.71, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(tetramethylphosphanium);sulfate is sourced from PubChem (CID 87132356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).