oxo-phenyl-thiophen-2-ylphosphanium

C10H8OPS+ — CID 118580329

IUPACoxo-phenyl-thiophen-2-ylphosphanium
SMILESO=[P+](c1ccccc1)c1cccs1
InChIInChI=1S/C10H8OPS/c11-12(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8H/q+1
InChIKeyNRNAPUKYQZSPTJ-UHFFFAOYSA-N
MW207.21 g/mol
LogP2.53
Rot. Bonds2

About oxo-phenyl-thiophen-2-ylphosphanium

oxo-phenyl-thiophen-2-ylphosphanium (PubChem CID 118580329) has the molecular formula C10H8OPS+ and a molecular weight of 207.21 g/mol. Its IUPAC name is oxo-phenyl-thiophen-2-ylphosphanium.

Molecular Properties

Compound Nameoxo-phenyl-thiophen-2-ylphosphanium
PubChem CID118580329
Molecular FormulaC10H8OPS+
Molecular Weight207.21 g/mol
Exact Mass207.00
IUPAC Nameoxo-phenyl-thiophen-2-ylphosphanium
SMILESO=[P+](c1ccccc1)c1cccs1
InChIInChI=1S/C10H8OPS/c11-12(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8H/q+1
InChIKeyNRNAPUKYQZSPTJ-UHFFFAOYSA-N
XLogP2.53
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.21
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of oxo-phenyl-thiophen-2-ylphosphanium?
The IUPAC name of oxo-phenyl-thiophen-2-ylphosphanium (CID 118580329) is oxo-phenyl-thiophen-2-ylphosphanium.
What is the SMILES notation for oxo-phenyl-thiophen-2-ylphosphanium?
The canonical SMILES for oxo-phenyl-thiophen-2-ylphosphanium is O=[P+](c1ccccc1)c1cccs1.
What is the InChIKey of oxo-phenyl-thiophen-2-ylphosphanium?
The InChIKey is NRNAPUKYQZSPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8OPS/c11-12(10-7-4-8-13-10)9-5-2-1-3-6-9/h1-8H/q+1.
What are the key properties of oxo-phenyl-thiophen-2-ylphosphanium?
oxo-phenyl-thiophen-2-ylphosphanium has a molecular weight of 207.21 g/mol, XLogP of 2.53, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxo-phenyl-thiophen-2-ylphosphanium is sourced from PubChem (CID 118580329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).