2-chloro-6-hydroxybenzenesulfonohydrazide

C6H7ClN2O3S — CID 54250889

IUPAC2-chloro-6-hydroxybenzenesulfonohydrazide
SMILESNNS(=O)(=O)c1c(O)cccc1Cl
InChIInChI=1S/C6H7ClN2O3S/c7-4-2-1-3-5(10)6(4)13(11,12)9-8/h1-3,9-10H,8H2
InChIKeyQWQUVKALWADBHE-UHFFFAOYSA-N
MW222.65 g/mol
LogP0.20
Rot. Bonds2

About 2-chloro-6-hydroxybenzenesulfonohydrazide

2-chloro-6-hydroxybenzenesulfonohydrazide (PubChem CID 54250889) has the molecular formula C6H7ClN2O3S and a molecular weight of 222.65 g/mol. Its IUPAC name is 2-chloro-6-hydroxybenzenesulfonohydrazide.

Molecular Properties

Compound Name2-chloro-6-hydroxybenzenesulfonohydrazide
PubChem CID54250889
Molecular FormulaC6H7ClN2O3S
Molecular Weight222.65 g/mol
Exact Mass221.99
IUPAC Name2-chloro-6-hydroxybenzenesulfonohydrazide
SMILESNNS(=O)(=O)c1c(O)cccc1Cl
InChIInChI=1S/C6H7ClN2O3S/c7-4-2-1-3-5(10)6(4)13(11,12)9-8/h1-3,9-10H,8H2
InChIKeyQWQUVKALWADBHE-UHFFFAOYSA-N
XLogP0.20
TPSA92.42 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.65
LogP ≤ 50.20
H-Bond Donors ≤ 53
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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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-hydroxybenzenesulfonohydrazide?
The IUPAC name of 2-chloro-6-hydroxybenzenesulfonohydrazide (CID 54250889) is 2-chloro-6-hydroxybenzenesulfonohydrazide.
What is the SMILES notation for 2-chloro-6-hydroxybenzenesulfonohydrazide?
The canonical SMILES for 2-chloro-6-hydroxybenzenesulfonohydrazide is NNS(=O)(=O)c1c(O)cccc1Cl.
What is the InChIKey of 2-chloro-6-hydroxybenzenesulfonohydrazide?
The InChIKey is QWQUVKALWADBHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN2O3S/c7-4-2-1-3-5(10)6(4)13(11,12)9-8/h1-3,9-10H,8H2.
What are the key properties of 2-chloro-6-hydroxybenzenesulfonohydrazide?
2-chloro-6-hydroxybenzenesulfonohydrazide has a molecular weight of 222.65 g/mol, XLogP of 0.20, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-hydroxybenzenesulfonohydrazide is sourced from PubChem (CID 54250889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).