tetrasodium ethyl phosphate

C4H10Na4O8P2 — CID 141178132

IUPACtetrasodium ethyl phosphate
SMILESCCOP(=O)([O-])[O-].CCOP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/2C2H7O4P.4Na/c2*1-2-6-7(3,4)5;;;;/h2*2H2,1H3,(H2,3,4,5);;;;/q;;4*+1/p-4
InChIKeyVVCANZHVHLKRML-UHFFFAOYSA-J
MW340.02 g/mol
LogP-14.28
Rot. Bonds4

About tetrasodium ethyl phosphate

tetrasodium ethyl phosphate (PubChem CID 141178132) has the molecular formula C4H10Na4O8P2 and a molecular weight of 340.02 g/mol. Its IUPAC name is tetrasodium ethyl phosphate.

Molecular Properties

Compound Nametetrasodium ethyl phosphate
PubChem CID141178132
Molecular FormulaC4H10Na4O8P2
Molecular Weight340.02 g/mol
Exact Mass339.94
IUPAC Nametetrasodium ethyl phosphate
SMILESCCOP(=O)([O-])[O-].CCOP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]
InChIInChI=1S/2C2H7O4P.4Na/c2*1-2-6-7(3,4)5;;;;/h2*2H2,1H3,(H2,3,4,5);;;;/q;;4*+1/p-4
InChIKeyVVCANZHVHLKRML-UHFFFAOYSA-J
XLogP-14.28
TPSA144.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.02
LogP ≤ 5-14.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze tetrasodium ethyl phosphate with MolForge

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

Launch Full Analysis

Related Compounds

disodium;ethyl phosphate
CID 11970393
barium(2+);ethyl phosphate
CID 12691393
ethyl phosphate;N-methylmethanamine
CID 19985438
disodium bis(diethyl phosphate)
CID 57370561
copper bis(diethyl phosphate)
CID 23448356
sodium ethyl methyl phosphate
CID 134607083
aluminum;triethyl phosphate;phosphate
CID 174993171
sodium 2-ethoxyethyl phosphate
CID 139597529
2-phosphonatooxyethyl phosphate
CID 22721325
disodium carboxymethyl(ethoxy)phosphinate
CID 158502512
propyl phosphate;bis(tetramethylphosphanium)
CID 87474534
ethyl hydroxymethyl phosphate
CID 153073426

Frequently Asked Questions

What is the IUPAC name of tetrasodium ethyl phosphate?
The IUPAC name of tetrasodium ethyl phosphate (CID 141178132) is tetrasodium ethyl phosphate.
What is the SMILES notation for tetrasodium ethyl phosphate?
The canonical SMILES for tetrasodium ethyl phosphate is CCOP(=O)([O-])[O-].CCOP(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+].
What is the InChIKey of tetrasodium ethyl phosphate?
The InChIKey is VVCANZHVHLKRML-UHFFFAOYSA-J. The full InChI is InChI=1S/2C2H7O4P.4Na/c2*1-2-6-7(3,4)5;;;;/h2*2H2,1H3,(H2,3,4,5);;;;/q;;4*+1/p-4.
What are the key properties of tetrasodium ethyl phosphate?
tetrasodium ethyl phosphate has a molecular weight of 340.02 g/mol, XLogP of -14.28, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for tetrasodium ethyl phosphate is sourced from PubChem (CID 141178132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).