trisodium;carbonic acid;hydride

C7H17Na3O21 — CID 173085889

IUPACtrisodium;carbonic acid;hydride
SMILESO=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.[H-].[H-].[H-].[Na+].[Na+].[Na+]
InChIInChI=1S/7CH2O3.3Na.3H/c7*2-1(3)4;;;;;;/h7*(H2,2,3,4);;;;;;/q;;;;;;;3*+1;3*-1
InChIKeyTUSNSVVYXFAPQE-UHFFFAOYSA-N
MW506.16 g/mol
LogP-7.09
Rot. Bonds

About trisodium;carbonic acid;hydride

trisodium;carbonic acid;hydride (PubChem CID 173085889) has the molecular formula C7H17Na3O21 and a molecular weight of 506.16 g/mol. Its IUPAC name is trisodium;carbonic acid;hydride.

Molecular Properties

Compound Nametrisodium;carbonic acid;hydride
PubChem CID173085889
Molecular FormulaC7H17Na3O21
Molecular Weight506.16 g/mol
Exact Mass506.00
IUPAC Nametrisodium;carbonic acid;hydride
SMILESO=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.[H-].[H-].[H-].[Na+].[Na+].[Na+]
InChIInChI=1S/7CH2O3.3Na.3H/c7*2-1(3)4;;;;;;/h7*(H2,2,3,4);;;;;;/q;;;;;;;3*+1;3*-1
InChIKeyTUSNSVVYXFAPQE-UHFFFAOYSA-N
XLogP-7.09
TPSA402.71 Ų
H-Bond Donors14
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500506.16
LogP ≤ 5-7.09
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 107

Analyze trisodium;carbonic acid;hydride 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 trisodium;carbonic acid;hydride?
The IUPAC name of trisodium;carbonic acid;hydride (CID 173085889) is trisodium;carbonic acid;hydride.
What is the SMILES notation for trisodium;carbonic acid;hydride?
The canonical SMILES for trisodium;carbonic acid;hydride is O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.[H-].[H-].[H-].[Na+].[Na+].[Na+].
What is the InChIKey of trisodium;carbonic acid;hydride?
The InChIKey is TUSNSVVYXFAPQE-UHFFFAOYSA-N. The full InChI is InChI=1S/7CH2O3.3Na.3H/c7*2-1(3)4;;;;;;/h7*(H2,2,3,4);;;;;;/q;;;;;;;3*+1;3*-1.
What are the key properties of trisodium;carbonic acid;hydride?
trisodium;carbonic acid;hydride has a molecular weight of 506.16 g/mol, XLogP of -7.09, 0 rotatable bonds, 14 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for trisodium;carbonic acid;hydride is sourced from PubChem (CID 173085889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).