sodium ethoxy(phenyl)phosphinite

C8H10NaO2P — CID 23703386

IUPACsodium ethoxy(phenyl)phosphinite
SMILESCCOP([O-])c1ccccc1.[Na+]
InChIInChI=1S/C8H10O2P.Na/c1-2-10-11(9)8-6-4-3-5-7-8;/h3-7H,2H2,1H3;/q-1;+1
InChIKeyFPKSKEKTSQBNNG-UHFFFAOYSA-N
MW192.13 g/mol
LogP-1.98
Rot. Bonds3

About sodium ethoxy(phenyl)phosphinite

sodium ethoxy(phenyl)phosphinite (PubChem CID 23703386) has the molecular formula C8H10NaO2P and a molecular weight of 192.13 g/mol. Its IUPAC name is sodium ethoxy(phenyl)phosphinite.

Molecular Properties

Compound Namesodium ethoxy(phenyl)phosphinite
PubChem CID23703386
Molecular FormulaC8H10NaO2P
Molecular Weight192.13 g/mol
Exact Mass192.03
IUPAC Namesodium ethoxy(phenyl)phosphinite
SMILESCCOP([O-])c1ccccc1.[Na+]
InChIInChI=1S/C8H10O2P.Na/c1-2-10-11(9)8-6-4-3-5-7-8;/h3-7H,2H2,1H3;/q-1;+1
InChIKeyFPKSKEKTSQBNNG-UHFFFAOYSA-N
XLogP-1.98
TPSA32.29 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.13
LogP ≤ 5-1.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze sodium ethoxy(phenyl)phosphinite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of sodium ethoxy(phenyl)phosphinite?
The IUPAC name of sodium ethoxy(phenyl)phosphinite (CID 23703386) is sodium ethoxy(phenyl)phosphinite.
What is the SMILES notation for sodium ethoxy(phenyl)phosphinite?
The canonical SMILES for sodium ethoxy(phenyl)phosphinite is CCOP([O-])c1ccccc1.[Na+].
What is the InChIKey of sodium ethoxy(phenyl)phosphinite?
The InChIKey is FPKSKEKTSQBNNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2P.Na/c1-2-10-11(9)8-6-4-3-5-7-8;/h3-7H,2H2,1H3;/q-1;+1.
What are the key properties of sodium ethoxy(phenyl)phosphinite?
sodium ethoxy(phenyl)phosphinite has a molecular weight of 192.13 g/mol, XLogP of -1.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for sodium ethoxy(phenyl)phosphinite is sourced from PubChem (CID 23703386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).