sodium;formic acid;nitrate

CH2NNaO5 — CID 21490945

IUPACsodium;formic acid;nitrate
SMILESO=CO.O=[N+]([O-])[O-].[Na+]
InChIInChI=1S/CH2O2.NO3.Na/c2-1-3;2-1(3)4;/h1H,(H,2,3);;/q;-1;+1
InChIKeyKXIDAZLKWZSOHV-UHFFFAOYSA-N
MW131.02 g/mol
LogP-3.53
Rot. Bonds

About sodium;formic acid;nitrate

sodium;formic acid;nitrate (PubChem CID 21490945) has the molecular formula CH2NNaO5 and a molecular weight of 131.02 g/mol. Its IUPAC name is sodium;formic acid;nitrate.

Molecular Properties

Compound Namesodium;formic acid;nitrate
PubChem CID21490945
Molecular FormulaCH2NNaO5
Molecular Weight131.02 g/mol
Exact Mass130.98
IUPAC Namesodium;formic acid;nitrate
SMILESO=CO.O=[N+]([O-])[O-].[Na+]
InChIInChI=1S/CH2O2.NO3.Na/c2-1-3;2-1(3)4;/h1H,(H,2,3);;/q;-1;+1
InChIKeyKXIDAZLKWZSOHV-UHFFFAOYSA-N
XLogP-3.53
TPSA103.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.02
LogP ≤ 5-3.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of sodium;formic acid;nitrate?
The IUPAC name of sodium;formic acid;nitrate (CID 21490945) is sodium;formic acid;nitrate.
What is the SMILES notation for sodium;formic acid;nitrate?
The canonical SMILES for sodium;formic acid;nitrate is O=CO.O=[N+]([O-])[O-].[Na+].
What is the InChIKey of sodium;formic acid;nitrate?
The InChIKey is KXIDAZLKWZSOHV-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O2.NO3.Na/c2-1-3;2-1(3)4;/h1H,(H,2,3);;/q;-1;+1.
What are the key properties of sodium;formic acid;nitrate?
sodium;formic acid;nitrate has a molecular weight of 131.02 g/mol, XLogP of -3.53, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;formic acid;nitrate is sourced from PubChem (CID 21490945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).