cesium;sodium;hydrogen carbonate;methanolate

C2H4CsNaO4 — CID 161153391

IUPACcesium;sodium;hydrogen carbonate;methanolate
SMILESC[O-].O=C([O-])O.[Cs+].[Na+]
InChIInChI=1S/CH2O3.CH3O.Cs.Na/c2-1(3)4;1-2;;/h(H2,2,3,4);1H3;;/q;-1;2*+1/p-1
InChIKeyNGASYGZJDHFJOA-UHFFFAOYSA-M
MW247.94 g/mol
LogP-8.13
Rot. Bonds

About cesium;sodium;hydrogen carbonate;methanolate

cesium;sodium;hydrogen carbonate;methanolate (PubChem CID 161153391) has the molecular formula C2H4CsNaO4 and a molecular weight of 247.94 g/mol. Its IUPAC name is cesium;sodium;hydrogen carbonate;methanolate.

Molecular Properties

Compound Namecesium;sodium;hydrogen carbonate;methanolate
PubChem CID161153391
Molecular FormulaC2H4CsNaO4
Molecular Weight247.94 g/mol
Exact Mass247.91
IUPAC Namecesium;sodium;hydrogen carbonate;methanolate
SMILESC[O-].O=C([O-])O.[Cs+].[Na+]
InChIInChI=1S/CH2O3.CH3O.Cs.Na/c2-1(3)4;1-2;;/h(H2,2,3,4);1H3;;/q;-1;2*+1/p-1
InChIKeyNGASYGZJDHFJOA-UHFFFAOYSA-M
XLogP-8.13
TPSA83.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.94
LogP ≤ 5-8.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze cesium;sodium;hydrogen carbonate;methanolate 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

potassium;sodium;hydrogen carbonate;methanolate
CID 140661129
sodium;hydrogen carbonate;rhodium(3+)
CID 158976789
copper;sodium;hydrogen carbonate
CID 158630048
hexatriacontasodium;carbonic acid;hydrogen carbonate
CID 173333851
sodium;arsane;hydrogen carbonate
CID 175072054
trisodium;hydrogen carbonate;acetate;hydroxide
CID 169079975
magnesium;sodium;hydrogen carbonate;dichloride
CID 175295989
sodium;zinc;hydrogen carbonate;carbonate
CID 161230627
sodium;barium(2+);hydrogen carbonate;carbonate
CID 159640552
trisodium;carbonic acid;hydrogen carbonate;carbonate
CID 173334422
calcium;sodium;strontium;hydrogen carbonate
CID 174700923
trisodium;hydrogen carbonate;carbonate;dihydrate
CID 91886149

Frequently Asked Questions

What is the IUPAC name of cesium;sodium;hydrogen carbonate;methanolate?
The IUPAC name of cesium;sodium;hydrogen carbonate;methanolate (CID 161153391) is cesium;sodium;hydrogen carbonate;methanolate.
What is the SMILES notation for cesium;sodium;hydrogen carbonate;methanolate?
The canonical SMILES for cesium;sodium;hydrogen carbonate;methanolate is C[O-].O=C([O-])O.[Cs+].[Na+].
What is the InChIKey of cesium;sodium;hydrogen carbonate;methanolate?
The InChIKey is NGASYGZJDHFJOA-UHFFFAOYSA-M. The full InChI is InChI=1S/CH2O3.CH3O.Cs.Na/c2-1(3)4;1-2;;/h(H2,2,3,4);1H3;;/q;-1;2*+1/p-1.
What are the key properties of cesium;sodium;hydrogen carbonate;methanolate?
cesium;sodium;hydrogen carbonate;methanolate has a molecular weight of 247.94 g/mol, XLogP of -8.13, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cesium;sodium;hydrogen carbonate;methanolate is sourced from PubChem (CID 161153391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).