sodium;oxaldehyde;hydroxide

C2H3NaO3 — CID 19869295

IUPACsodium;oxaldehyde;hydroxide
SMILESO=CC=O.[Na+].[OH-]
InChIInChI=1S/C2H2O2.Na.H2O/c3-1-2-4;;/h1-2H;;1H2/q;+1;/p-1
InChIKeyDGWOOZMTJDLLQE-UHFFFAOYSA-M
MW98.03 g/mol
LogP-3.79
Rot. Bonds1

About sodium;oxaldehyde;hydroxide

sodium;oxaldehyde;hydroxide (PubChem CID 19869295) has the molecular formula C2H3NaO3 and a molecular weight of 98.03 g/mol. Its IUPAC name is sodium;oxaldehyde;hydroxide.

Molecular Properties

Compound Namesodium;oxaldehyde;hydroxide
PubChem CID19869295
Molecular FormulaC2H3NaO3
Molecular Weight98.03 g/mol
Exact Mass98.00
IUPAC Namesodium;oxaldehyde;hydroxide
SMILESO=CC=O.[Na+].[OH-]
InChIInChI=1S/C2H2O2.Na.H2O/c3-1-2-4;;/h1-2H;;1H2/q;+1;/p-1
InChIKeyDGWOOZMTJDLLQE-UHFFFAOYSA-M
XLogP-3.79
TPSA64.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.03
LogP ≤ 5-3.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of sodium;oxaldehyde;hydroxide?
The IUPAC name of sodium;oxaldehyde;hydroxide (CID 19869295) is sodium;oxaldehyde;hydroxide.
What is the SMILES notation for sodium;oxaldehyde;hydroxide?
The canonical SMILES for sodium;oxaldehyde;hydroxide is O=CC=O.[Na+].[OH-].
What is the InChIKey of sodium;oxaldehyde;hydroxide?
The InChIKey is DGWOOZMTJDLLQE-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H2O2.Na.H2O/c3-1-2-4;;/h1-2H;;1H2/q;+1;/p-1.
What are the key properties of sodium;oxaldehyde;hydroxide?
sodium;oxaldehyde;hydroxide has a molecular weight of 98.03 g/mol, XLogP of -3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;oxaldehyde;hydroxide is sourced from PubChem (CID 19869295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).