disodium;dioxido(phenyl)phosphane

C6H5Na2O2P — CID 22598239

IUPACdisodium;dioxido(phenyl)phosphane
SMILES[Na+].[Na+].[O-]P([O-])c1ccccc1
InChIInChI=1S/C6H5O2P.2Na/c7-9(8)6-4-2-1-3-5-6;;/h1-5H;;/q-2;2*+1
InChIKeyVRIZGLPHNWWKPU-UHFFFAOYSA-N
MW186.06 g/mol
LogP-6.65
Rot. Bonds1

About disodium;dioxido(phenyl)phosphane

disodium;dioxido(phenyl)phosphane (PubChem CID 22598239) has the molecular formula C6H5Na2O2P and a molecular weight of 186.06 g/mol. Its IUPAC name is disodium;dioxido(phenyl)phosphane.

Molecular Properties

Compound Namedisodium;dioxido(phenyl)phosphane
PubChem CID22598239
Molecular FormulaC6H5Na2O2P
Molecular Weight186.06 g/mol
Exact Mass185.98
IUPAC Namedisodium;dioxido(phenyl)phosphane
SMILES[Na+].[Na+].[O-]P([O-])c1ccccc1
InChIInChI=1S/C6H5O2P.2Na/c7-9(8)6-4-2-1-3-5-6;;/h1-5H;;/q-2;2*+1
InChIKeyVRIZGLPHNWWKPU-UHFFFAOYSA-N
XLogP-6.65
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.06
LogP ≤ 5-6.65
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 disodium;dioxido(phenyl)phosphane?
The IUPAC name of disodium;dioxido(phenyl)phosphane (CID 22598239) is disodium;dioxido(phenyl)phosphane.
What is the SMILES notation for disodium;dioxido(phenyl)phosphane?
The canonical SMILES for disodium;dioxido(phenyl)phosphane is [Na+].[Na+].[O-]P([O-])c1ccccc1.
What is the InChIKey of disodium;dioxido(phenyl)phosphane?
The InChIKey is VRIZGLPHNWWKPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5O2P.2Na/c7-9(8)6-4-2-1-3-5-6;;/h1-5H;;/q-2;2*+1.
What are the key properties of disodium;dioxido(phenyl)phosphane?
disodium;dioxido(phenyl)phosphane has a molecular weight of 186.06 g/mol, XLogP of -6.65, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;dioxido(phenyl)phosphane is sourced from PubChem (CID 22598239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).