sodium;azane;2-hydroxy-2-oxoacetate;nitric acid

C2H5N2NaO7 — CID 175034311

IUPACsodium;azane;2-hydroxy-2-oxoacetate;nitric acid
SMILESN.O=C([O-])C(=O)O.O=[N+]([O-])O.[Na+]
InChIInChI=1S/C2H2O4.HNO3.H3N.Na/c3-1(4)2(5)6;2-1(3)4;;/h(H,3,4)(H,5,6);(H,2,3,4);1H3;/q;;;+1/p-1
InChIKeyNMQYBTHSFNLTRW-UHFFFAOYSA-M
MW192.06 g/mol
LogP-5.36
Rot. Bonds

About sodium;azane;2-hydroxy-2-oxoacetate;nitric acid

sodium;azane;2-hydroxy-2-oxoacetate;nitric acid (PubChem CID 175034311) has the molecular formula C2H5N2NaO7 and a molecular weight of 192.06 g/mol. Its IUPAC name is sodium;azane;2-hydroxy-2-oxoacetate;nitric acid.

Molecular Properties

Compound Namesodium;azane;2-hydroxy-2-oxoacetate;nitric acid
PubChem CID175034311
Molecular FormulaC2H5N2NaO7
Molecular Weight192.06 g/mol
Exact Mass192.00
IUPAC Namesodium;azane;2-hydroxy-2-oxoacetate;nitric acid
SMILESN.O=C([O-])C(=O)O.O=[N+]([O-])O.[Na+]
InChIInChI=1S/C2H2O4.HNO3.H3N.Na/c3-1(4)2(5)6;2-1(3)4;;/h(H,3,4)(H,5,6);(H,2,3,4);1H3;/q;;;+1/p-1
InChIKeyNMQYBTHSFNLTRW-UHFFFAOYSA-M
XLogP-5.36
TPSA175.80 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.06
LogP ≤ 5-5.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

sodium;2-hydroxy-2-oxoacetate;hydrochloride
CID 141113765
azane;hydron;2-hydroxy-2-oxoacetate
CID 173005395
azane;tetrakis(nitric acid)
CID 173388272
tripentacontapotassium;pentakis(nitric acid)
CID 173441316
azane;decakis(nitric acid)
CID 173055393
azane;(nitric acid)
CID 173431766
hydrogen peroxide;nitric acid
CID 22590704
dilithium;hydride;nitric acid;oxalic acid
CID 173422788
carbonic acid;methane;nitric acid
CID 172861779
carbonic acid;cerium;nitric acid
CID 174736285
potassium;hydride;tetrakis(nitric acid)
CID 173316593
azane;nitric acid;hydrochloride
CID 173035617

Frequently Asked Questions

What is the IUPAC name of sodium;azane;2-hydroxy-2-oxoacetate;nitric acid?
The IUPAC name of sodium;azane;2-hydroxy-2-oxoacetate;nitric acid (CID 175034311) is sodium;azane;2-hydroxy-2-oxoacetate;nitric acid.
What is the SMILES notation for sodium;azane;2-hydroxy-2-oxoacetate;nitric acid?
The canonical SMILES for sodium;azane;2-hydroxy-2-oxoacetate;nitric acid is N.O=C([O-])C(=O)O.O=[N+]([O-])O.[Na+].
What is the InChIKey of sodium;azane;2-hydroxy-2-oxoacetate;nitric acid?
The InChIKey is NMQYBTHSFNLTRW-UHFFFAOYSA-M. The full InChI is InChI=1S/C2H2O4.HNO3.H3N.Na/c3-1(4)2(5)6;2-1(3)4;;/h(H,3,4)(H,5,6);(H,2,3,4);1H3;/q;;;+1/p-1.
What are the key properties of sodium;azane;2-hydroxy-2-oxoacetate;nitric acid?
sodium;azane;2-hydroxy-2-oxoacetate;nitric acid has a molecular weight of 192.06 g/mol, XLogP of -5.36, 0 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;azane;2-hydroxy-2-oxoacetate;nitric acid is sourced from PubChem (CID 175034311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).