CID 159720912

H6O3P2S — CID 159720912

IUPAC—
SMILESO=S(=O)(O)P.P
InChIInChI=1S/H3O3PS.H3P/c1-5(2,3)4;/h4H2,(H,1,2,3);1H3
InChIKeyKKZXAKLQBBRLIE-UHFFFAOYSA-N
MW148.06 g/mol
LogP-0.28
Rot. Bonds

About CID 159720912

CID 159720912 (PubChem CID 159720912) has the molecular formula H6O3P2S and a molecular weight of 148.06 g/mol.

Molecular Properties

Compound NameCID 159720912
PubChem CID159720912
Molecular FormulaH6O3P2S
Molecular Weight148.06 g/mol
Exact Mass147.95
IUPAC Name—
SMILESO=S(=O)(O)P.P
InChIInChI=1S/H3O3PS.H3P/c1-5(2,3)4;/h4H2,(H,1,2,3);1H3
InChIKeyKKZXAKLQBBRLIE-UHFFFAOYSA-N
XLogP-0.28
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.06
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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azane;sulfuric acid
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sulfuric acid;zinc
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cerium;sulfuric acid
CID 45051640
bismuthane;sulfuric acid
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(barium(2+));sulfuric acid
CID 173434226
methane;sulfuric acid
CID 174865737

Frequently Asked Questions

What is the IUPAC name of CID 159720912?
The IUPAC name of CID 159720912 (CID 159720912) is not available.
What is the SMILES notation for CID 159720912?
The canonical SMILES for CID 159720912 is O=S(=O)(O)P.P.
What is the InChIKey of CID 159720912?
The InChIKey is KKZXAKLQBBRLIE-UHFFFAOYSA-N. The full InChI is InChI=1S/H3O3PS.H3P/c1-5(2,3)4;/h4H2,(H,1,2,3);1H3.
What are the key properties of CID 159720912?
CID 159720912 has a molecular weight of 148.06 g/mol, XLogP of -0.28, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159720912 is sourced from PubChem (CID 159720912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).