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4-Hydrazinobenzenesulfonamide
CAS: 4392-54-5 | C6H9N3O2S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4392-54-5
Molecular Formula:
C6H9N3O2S
Molecular Mass:
187.22 g/mol
Names and Synonyms:
4-Hydrazinobenzenesulfonamide
Benzenesulfonamide, 4-hydrazinyl-
Benzenesulfonamide, p-hydrazino-
Benzenesulfonamide, 4-hydrazino-
4-Hydrazinylbenzenesulfonamide
(p-Sulfamoylphenyl)hydrazine
(4-Sulfamoylphenyl)hydrazine
4-(Aminosulfonyl)phenylhydrazine
p-Hydrazinobenzenesulfonamide
4-Hydrazinobenzenesulfonamide
NSC 73246
N-(4-Aminosulfonylphenyl)hydrazine
Resist H
Identifiers:
SMILES:
NNc1ccc(S(N)(=O)=O)cc1
InChI:
InChI=1S/C6H9N3O2S/c7-9-5-1-3-6(4-2-5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11)
Key Properties
Melting Point
155 °C
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 187.22 g/mol | CAS Common Chemistry |
| 187.224 g/mol | RDKit | |
| 187.041547528 g/mol | RDKit | |
| Canonical SMILES | O=S(=O)(N)C1=CC=C(C=C1)NN | CAS Common Chemistry |
| InChI | InChI=1S/C6H9N3O2S/c7-9-5-1-3-6(4-2-5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11) | CAS Common Chemistry |
| InChI Key | InChIKey=NBJSNAGTUCWQRO-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 155 °C | CAS Common Chemistry |
| Name | 4-Hydrazinobenzenesulfonamide | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 3 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 98.20999999999998 Ų | RDKit |
| LogP | -0.3803999999999996 | RDKit |
| Molar Refractivity | 45.6253 | RDKit |
