sodium 4-(hydrazinesulfonyl)phenolate

C6H7N2NaO3S — CID 143649981

IUPACsodium 4-(hydrazinesulfonyl)phenolate
SMILESNNS(=O)(=O)c1ccc([O-])cc1.[Na+]
InChIInChI=1S/C6H8N2O3S.Na/c7-8-12(10,11)6-3-1-5(9)2-4-6;/h1-4,8-9H,7H2;/q;+1/p-1
InChIKeyZIAQFRREUMLYKJ-UHFFFAOYSA-M
MW210.19 g/mol
LogP-4.08
Rot. Bonds2

About sodium 4-(hydrazinesulfonyl)phenolate

sodium 4-(hydrazinesulfonyl)phenolate (PubChem CID 143649981) has the molecular formula C6H7N2NaO3S and a molecular weight of 210.19 g/mol. Its IUPAC name is sodium 4-(hydrazinesulfonyl)phenolate.

Molecular Properties

Compound Namesodium 4-(hydrazinesulfonyl)phenolate
PubChem CID143649981
Molecular FormulaC6H7N2NaO3S
Molecular Weight210.19 g/mol
Exact Mass210.01
IUPAC Namesodium 4-(hydrazinesulfonyl)phenolate
SMILESNNS(=O)(=O)c1ccc([O-])cc1.[Na+]
InChIInChI=1S/C6H8N2O3S.Na/c7-8-12(10,11)6-3-1-5(9)2-4-6;/h1-4,8-9H,7H2;/q;+1/p-1
InChIKeyZIAQFRREUMLYKJ-UHFFFAOYSA-M
XLogP-4.08
TPSA95.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.19
LogP ≤ 5-4.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-methylbenzenesulfonohydrazide
CID 15303
4-[[4-(hydrazinesulfonyl)phenyl]methyl]benzenesulfonohydrazide
CID 14048861
benzenesulfonohydrazide;hydrate
CID 21414143
4-propan-2-ylbenzenesulfonohydrazide
CID 17372434
4-(4-methylphenoxy)benzenesulfonohydrazide
CID 90979703
4-(trifluoromethoxy)benzenesulfonohydrazide
CID 2744727
3,4-dichlorobenzenesulfonohydrazide
CID 2735965
4-butylbenzenesulfonohydrazide
CID 17255521
(Z)-4-[4-(hydrazinesulfonyl)phenoxy]-4-oxobut-2-enoic acid
CID 67617126
ethyl 4-(hydrazinesulfonyl)benzoate
CID 19755145
benzenesulfonohydrazide;(E)-carbamoyliminourea
CID 18359618
4-(2-methoxyethylamino)benzenesulfonohydrazide
CID 174874042

Frequently Asked Questions

What is the IUPAC name of sodium 4-(hydrazinesulfonyl)phenolate?
The IUPAC name of sodium 4-(hydrazinesulfonyl)phenolate (CID 143649981) is sodium 4-(hydrazinesulfonyl)phenolate.
What is the SMILES notation for sodium 4-(hydrazinesulfonyl)phenolate?
The canonical SMILES for sodium 4-(hydrazinesulfonyl)phenolate is NNS(=O)(=O)c1ccc([O-])cc1.[Na+].
What is the InChIKey of sodium 4-(hydrazinesulfonyl)phenolate?
The InChIKey is ZIAQFRREUMLYKJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H8N2O3S.Na/c7-8-12(10,11)6-3-1-5(9)2-4-6;/h1-4,8-9H,7H2;/q;+1/p-1.
What are the key properties of sodium 4-(hydrazinesulfonyl)phenolate?
sodium 4-(hydrazinesulfonyl)phenolate has a molecular weight of 210.19 g/mol, XLogP of -4.08, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for sodium 4-(hydrazinesulfonyl)phenolate is sourced from PubChem (CID 143649981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).