diazomethylsulfonylbenzene;hydrazine

C7H10N4O2S — CID 161243930

IUPACdiazomethylsulfonylbenzene;hydrazine
SMILESNN.[N-]=[N+]=CS(=O)(=O)c1ccccc1
InChIInChI=1S/C7H6N2O2S.H4N2/c8-9-6-12(10,11)7-4-2-1-3-5-7;1-2/h1-6H;1-2H2
InChIKeyVAJLERFMBKXJLO-UHFFFAOYSA-N
MW214.25 g/mol
LogP-0.46
Rot. Bonds2

About diazomethylsulfonylbenzene;hydrazine

diazomethylsulfonylbenzene;hydrazine (PubChem CID 161243930) has the molecular formula C7H10N4O2S and a molecular weight of 214.25 g/mol. Its IUPAC name is diazomethylsulfonylbenzene;hydrazine.

Molecular Properties

Compound Namediazomethylsulfonylbenzene;hydrazine
PubChem CID161243930
Molecular FormulaC7H10N4O2S
Molecular Weight214.25 g/mol
Exact Mass214.05
IUPAC Namediazomethylsulfonylbenzene;hydrazine
SMILESNN.[N-]=[N+]=CS(=O)(=O)c1ccccc1
InChIInChI=1S/C7H6N2O2S.H4N2/c8-9-6-12(10,11)7-4-2-1-3-5-7;1-2/h1-6H;1-2H2
InChIKeyVAJLERFMBKXJLO-UHFFFAOYSA-N
XLogP-0.46
TPSA122.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.25
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diazomethylsulfonylbenzene;hydrazine?
The IUPAC name of diazomethylsulfonylbenzene;hydrazine (CID 161243930) is diazomethylsulfonylbenzene;hydrazine.
What is the SMILES notation for diazomethylsulfonylbenzene;hydrazine?
The canonical SMILES for diazomethylsulfonylbenzene;hydrazine is NN.[N-]=[N+]=CS(=O)(=O)c1ccccc1.
What is the InChIKey of diazomethylsulfonylbenzene;hydrazine?
The InChIKey is VAJLERFMBKXJLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O2S.H4N2/c8-9-6-12(10,11)7-4-2-1-3-5-7;1-2/h1-6H;1-2H2.
What are the key properties of diazomethylsulfonylbenzene;hydrazine?
diazomethylsulfonylbenzene;hydrazine has a molecular weight of 214.25 g/mol, XLogP of -0.46, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for diazomethylsulfonylbenzene;hydrazine is sourced from PubChem (CID 161243930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).