disodium;hydride;2-nitrophenol

C6H7NNa2O3 — CID 174745512

IUPACdisodium;hydride;2-nitrophenol
SMILESO=[N+]([O-])c1ccccc1O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C6H5NO3.2Na.2H/c8-6-4-2-1-3-5(6)7(9)10;;;;/h1-4,8H;;;;/q;2*+1;2*-1
InChIKeyVEMZWTBGVQAZFY-UHFFFAOYSA-N
MW187.11 g/mol
LogP-4.47
Rot. Bonds1

About disodium;hydride;2-nitrophenol

disodium;hydride;2-nitrophenol (PubChem CID 174745512) has the molecular formula C6H7NNa2O3 and a molecular weight of 187.11 g/mol. Its IUPAC name is disodium;hydride;2-nitrophenol.

Molecular Properties

Compound Namedisodium;hydride;2-nitrophenol
PubChem CID174745512
Molecular FormulaC6H7NNa2O3
Molecular Weight187.11 g/mol
Exact Mass187.02
IUPAC Namedisodium;hydride;2-nitrophenol
SMILESO=[N+]([O-])c1ccccc1O.[H-].[H-].[Na+].[Na+]
InChIInChI=1S/C6H5NO3.2Na.2H/c8-6-4-2-1-3-5(6)7(9)10;;;;/h1-4,8H;;;;/q;2*+1;2*-1
InChIKeyVEMZWTBGVQAZFY-UHFFFAOYSA-N
XLogP-4.47
TPSA63.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.11
LogP ≤ 5-4.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 disodium;hydride;2-nitrophenol?
The IUPAC name of disodium;hydride;2-nitrophenol (CID 174745512) is disodium;hydride;2-nitrophenol.
What is the SMILES notation for disodium;hydride;2-nitrophenol?
The canonical SMILES for disodium;hydride;2-nitrophenol is O=[N+]([O-])c1ccccc1O.[H-].[H-].[Na+].[Na+].
What is the InChIKey of disodium;hydride;2-nitrophenol?
The InChIKey is VEMZWTBGVQAZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5NO3.2Na.2H/c8-6-4-2-1-3-5(6)7(9)10;;;;/h1-4,8H;;;;/q;2*+1;2*-1.
What are the key properties of disodium;hydride;2-nitrophenol?
disodium;hydride;2-nitrophenol has a molecular weight of 187.11 g/mol, XLogP of -4.47, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for disodium;hydride;2-nitrophenol is sourced from PubChem (CID 174745512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).