dihydroxy(sulfanylimino)phosphanium

H3NO2PS+ — CID 173307820

IUPACdihydroxy(sulfanylimino)phosphanium
SMILESO[P+](O)=NS
InChIInChI=1S/H2NO2PS/c2-4(3)1-5/h(H2-,1,2,3,5)/p+1
InChIKeyJCDIOVBIRLASNH-UHFFFAOYSA-O
MW112.07 g/mol
LogP0.31
Rot. Bonds

About dihydroxy(sulfanylimino)phosphanium

dihydroxy(sulfanylimino)phosphanium (PubChem CID 173307820) has the molecular formula H3NO2PS+ and a molecular weight of 112.07 g/mol. Its IUPAC name is dihydroxy(sulfanylimino)phosphanium.

Molecular Properties

Compound Namedihydroxy(sulfanylimino)phosphanium
PubChem CID173307820
Molecular FormulaH3NO2PS+
Molecular Weight112.07 g/mol
Exact Mass111.96
IUPAC Namedihydroxy(sulfanylimino)phosphanium
SMILESO[P+](O)=NS
InChIInChI=1S/H2NO2PS/c2-4(3)1-5/h(H2-,1,2,3,5)/p+1
InChIKeyJCDIOVBIRLASNH-UHFFFAOYSA-O
XLogP0.31
TPSA52.82 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.07
LogP ≤ 50.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

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barium(2+);phosphenous acid
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bis(dihydroxy(oxo)phosphanium);technetium-99
CID 6328361
dihydroxy(oxo)phosphanium;samarium
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phosphenous acid;tantalum(5+)
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cadmium(2+);dihydroxy(oxo)phosphanium
CID 22506351
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CID 161252103

Frequently Asked Questions

What is the IUPAC name of dihydroxy(sulfanylimino)phosphanium?
The IUPAC name of dihydroxy(sulfanylimino)phosphanium (CID 173307820) is dihydroxy(sulfanylimino)phosphanium.
What is the SMILES notation for dihydroxy(sulfanylimino)phosphanium?
The canonical SMILES for dihydroxy(sulfanylimino)phosphanium is O[P+](O)=NS.
What is the InChIKey of dihydroxy(sulfanylimino)phosphanium?
The InChIKey is JCDIOVBIRLASNH-UHFFFAOYSA-O. The full InChI is InChI=1S/H2NO2PS/c2-4(3)1-5/h(H2-,1,2,3,5)/p+1.
What are the key properties of dihydroxy(sulfanylimino)phosphanium?
dihydroxy(sulfanylimino)phosphanium has a molecular weight of 112.07 g/mol, XLogP of 0.31, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dihydroxy(sulfanylimino)phosphanium is sourced from PubChem (CID 173307820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).