disodium;boric acid;carbonic acid;carbonate

C2H5BNa2O9 — CID 158571520

IUPACdisodium;boric acid;carbonic acid;carbonate
SMILESO=C(O)O.O=C([O-])[O-].OB(O)O.[Na+].[Na+]
InChIInChI=1S/2CH2O3.BH3O3.2Na/c3*2-1(3)4;;/h2*(H2,2,3,4);2-4H;;/q;;;2*+1/p-2
InChIKeyHSDGYCLMTPKXNH-UHFFFAOYSA-L
MW229.84 g/mol
LogP-10.27
Rot. Bonds

About disodium;boric acid;carbonic acid;carbonate

disodium;boric acid;carbonic acid;carbonate (PubChem CID 158571520) has the molecular formula C2H5BNa2O9 and a molecular weight of 229.84 g/mol. Its IUPAC name is disodium;boric acid;carbonic acid;carbonate.

Molecular Properties

Compound Namedisodium;boric acid;carbonic acid;carbonate
PubChem CID158571520
Molecular FormulaC2H5BNa2O9
Molecular Weight229.84 g/mol
Exact Mass229.98
IUPAC Namedisodium;boric acid;carbonic acid;carbonate
SMILESO=C(O)O.O=C([O-])[O-].OB(O)O.[Na+].[Na+]
InChIInChI=1S/2CH2O3.BH3O3.2Na/c3*2-1(3)4;;/h2*(H2,2,3,4);2-4H;;/q;;;2*+1/p-2
InChIKeyHSDGYCLMTPKXNH-UHFFFAOYSA-L
XLogP-10.27
TPSA181.41 Ų
H-Bond Donors5
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.84
LogP ≤ 5-10.27
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

dodecasodium;carbonic acid;hexacarbonate
CID 173011639
pentacontasodium;carbonic acid;pentacosacarbonate
CID 173275921
icosasodium;carbonic acid;decacarbonate
CID 173436065
disodium;boric acid;hydrogen carbonate;hydroxide
CID 160828512
barium(2+);boric acid;carbonate
CID 175313768
trisodium;carbonic acid;hydrogen carbonate;carbonate
CID 173334422
dipotassium;disodium;azane;carbonic acid;dicarbonate
CID 173340868
decapotassium;carbonic acid;pentacarbonate
CID 173334932
hexatriacontasodium;carbonic acid;hydrogen carbonate
CID 173333851
triacontacalcium;carbonic acid;triacontacarbonate
CID 173108074
triacontamagnesium;carbonic acid;triacontacarbonate
CID 173337540
decacalcium;carbonic acid;decacarbonate
CID 173264131

Frequently Asked Questions

What is the IUPAC name of disodium;boric acid;carbonic acid;carbonate?
The IUPAC name of disodium;boric acid;carbonic acid;carbonate (CID 158571520) is disodium;boric acid;carbonic acid;carbonate.
What is the SMILES notation for disodium;boric acid;carbonic acid;carbonate?
The canonical SMILES for disodium;boric acid;carbonic acid;carbonate is O=C(O)O.O=C([O-])[O-].OB(O)O.[Na+].[Na+].
What is the InChIKey of disodium;boric acid;carbonic acid;carbonate?
The InChIKey is HSDGYCLMTPKXNH-UHFFFAOYSA-L. The full InChI is InChI=1S/2CH2O3.BH3O3.2Na/c3*2-1(3)4;;/h2*(H2,2,3,4);2-4H;;/q;;;2*+1/p-2.
What are the key properties of disodium;boric acid;carbonic acid;carbonate?
disodium;boric acid;carbonic acid;carbonate has a molecular weight of 229.84 g/mol, XLogP of -10.27, 0 rotatable bonds, 5 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;boric acid;carbonic acid;carbonate is sourced from PubChem (CID 158571520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).