disodium;carbonic acid;hydride

C9H20Na2O27 — CID 173241390

IUPACdisodium;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.O=C(O)O.O=C(O)O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/9CH2O3.2Na.2H/c9*2-1(3)4;;;;/h9*(H2,2,3,4);;;;/q;;;;;;;;;2*+1;2*-1
InChIKeyMWMTXBGMOXEIAL-UHFFFAOYSA-N
MW606.21 g/mol
LogP-3.77
Rot. Bonds

About disodium;carbonic acid;hydride

disodium;carbonic acid;hydride (PubChem CID 173241390) has the molecular formula C9H20Na2O27 and a molecular weight of 606.21 g/mol. Its IUPAC name is disodium;carbonic acid;hydride.

Molecular Properties

Compound Namedisodium;carbonic acid;hydride
PubChem CID173241390
Molecular FormulaC9H20Na2O27
Molecular Weight606.21 g/mol
Exact Mass606.00
IUPAC Namedisodium;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.O=C(O)O.O=C(O)O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/9CH2O3.2Na.2H/c9*2-1(3)4;;;;/h9*(H2,2,3,4);;;;/q;;;;;;;;;2*+1;2*-1
InChIKeyMWMTXBGMOXEIAL-UHFFFAOYSA-N
XLogP-3.77
TPSA517.77 Ų
H-Bond Donors18
H-Bond Acceptors9
Rotatable Bonds
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500606.21
LogP ≤ 5-3.77
H-Bond Donors ≤ 518
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of disodium;carbonic acid;hydride?
The IUPAC name of disodium;carbonic acid;hydride (CID 173241390) is disodium;carbonic acid;hydride.
What is the SMILES notation for disodium;carbonic acid;hydride?
The canonical SMILES for disodium;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.O=C(O)O.O=C(O)O.[H-].[H-].[Na+].[Na+].
What is the InChIKey of disodium;carbonic acid;hydride?
The InChIKey is MWMTXBGMOXEIAL-UHFFFAOYSA-N. The full InChI is InChI=1S/9CH2O3.2Na.2H/c9*2-1(3)4;;;;/h9*(H2,2,3,4);;;;/q;;;;;;;;;2*+1;2*-1.
What are the key properties of disodium;carbonic acid;hydride?
disodium;carbonic acid;hydride has a molecular weight of 606.21 g/mol, XLogP of -3.77, 0 rotatable bonds, 18 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;carbonic acid;hydride is sourced from PubChem (CID 173241390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).