(4-methylsulfonylphenyl)hydrazine;hydrochloride

C7H11ClN2O2S — CID 2735181

IUPAC(4-methylsulfonylphenyl)hydrazine;hydrochloride
SMILESCS(=O)(=O)c1ccc(NN)cc1.Cl
InChIInChI=1S/C7H10N2O2S.ClH/c1-12(10,11)7-4-2-6(9-8)3-5-7;/h2-5,9H,8H2,1H3;1H
InChIKeyQVCMFSJTNVQJFG-UHFFFAOYSA-N
MW222.70 g/mol
LogP0.80
Rot. Bonds2

About (4-methylsulfonylphenyl)hydrazine;hydrochloride

(4-methylsulfonylphenyl)hydrazine;hydrochloride (PubChem CID 2735181) has the molecular formula C7H11ClN2O2S and a molecular weight of 222.70 g/mol. Its IUPAC name is (4-methylsulfonylphenyl)hydrazine;hydrochloride.

Molecular Properties

Compound Name(4-methylsulfonylphenyl)hydrazine;hydrochloride
PubChem CID2735181
Molecular FormulaC7H11ClN2O2S
Molecular Weight222.70 g/mol
Exact Mass222.02
IUPAC Name(4-methylsulfonylphenyl)hydrazine;hydrochloride
SMILESCS(=O)(=O)c1ccc(NN)cc1.Cl
InChIInChI=1S/C7H10N2O2S.ClH/c1-12(10,11)7-4-2-6(9-8)3-5-7;/h2-5,9H,8H2,1H3;1H
InChIKeyQVCMFSJTNVQJFG-UHFFFAOYSA-N
XLogP0.80
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.70
LogP ≤ 50.80
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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Frequently Asked Questions

What is the IUPAC name of (4-methylsulfonylphenyl)hydrazine;hydrochloride?
The IUPAC name of (4-methylsulfonylphenyl)hydrazine;hydrochloride (CID 2735181) is (4-methylsulfonylphenyl)hydrazine;hydrochloride.
What is the SMILES notation for (4-methylsulfonylphenyl)hydrazine;hydrochloride?
The canonical SMILES for (4-methylsulfonylphenyl)hydrazine;hydrochloride is CS(=O)(=O)c1ccc(NN)cc1.Cl.
What is the InChIKey of (4-methylsulfonylphenyl)hydrazine;hydrochloride?
The InChIKey is QVCMFSJTNVQJFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O2S.ClH/c1-12(10,11)7-4-2-6(9-8)3-5-7;/h2-5,9H,8H2,1H3;1H.
What are the key properties of (4-methylsulfonylphenyl)hydrazine;hydrochloride?
(4-methylsulfonylphenyl)hydrazine;hydrochloride has a molecular weight of 222.70 g/mol, XLogP of 0.80, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylsulfonylphenyl)hydrazine;hydrochloride is sourced from PubChem (CID 2735181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).