(2-chlorophenyl)-oxo-phenylphosphanium

C12H9ClOP+ — CID 67297944

IUPAC(2-chlorophenyl)-oxo-phenylphosphanium
SMILESO=[P+](c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C12H9ClOP/c13-11-8-4-5-9-12(11)15(14)10-6-2-1-3-7-10/h1-9H/q+1
InChIKeyGVRPWXMGKQZJCL-UHFFFAOYSA-N
MW235.63 g/mol
LogP3.12
Rot. Bonds2

About (2-chlorophenyl)-oxo-phenylphosphanium

(2-chlorophenyl)-oxo-phenylphosphanium (PubChem CID 67297944) has the molecular formula C12H9ClOP+ and a molecular weight of 235.63 g/mol. Its IUPAC name is (2-chlorophenyl)-oxo-phenylphosphanium.

Molecular Properties

Compound Name(2-chlorophenyl)-oxo-phenylphosphanium
PubChem CID67297944
Molecular FormulaC12H9ClOP+
Molecular Weight235.63 g/mol
Exact Mass235.01
IUPAC Name(2-chlorophenyl)-oxo-phenylphosphanium
SMILESO=[P+](c1ccccc1)c1ccccc1Cl
InChIInChI=1S/C12H9ClOP/c13-11-8-4-5-9-12(11)15(14)10-6-2-1-3-7-10/h1-9H/q+1
InChIKeyGVRPWXMGKQZJCL-UHFFFAOYSA-N
XLogP3.12
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.63
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-oxo-phenylphosphanium?
The IUPAC name of (2-chlorophenyl)-oxo-phenylphosphanium (CID 67297944) is (2-chlorophenyl)-oxo-phenylphosphanium.
What is the SMILES notation for (2-chlorophenyl)-oxo-phenylphosphanium?
The canonical SMILES for (2-chlorophenyl)-oxo-phenylphosphanium is O=[P+](c1ccccc1)c1ccccc1Cl.
What is the InChIKey of (2-chlorophenyl)-oxo-phenylphosphanium?
The InChIKey is GVRPWXMGKQZJCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClOP/c13-11-8-4-5-9-12(11)15(14)10-6-2-1-3-7-10/h1-9H/q+1.
What are the key properties of (2-chlorophenyl)-oxo-phenylphosphanium?
(2-chlorophenyl)-oxo-phenylphosphanium has a molecular weight of 235.63 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-oxo-phenylphosphanium is sourced from PubChem (CID 67297944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).