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Sulfanilamide
CAS: 63-74-1 | C6H8N2O2S
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
63-74-1
Molecular Formula:
C6H8N2O2S
Molecular Weight:
172.20900000000003 g/mol
Names and Synonyms:
Sulfanilamide
Common Name
1162F
Synonym
4-Aminobenzenesulfonic acid amide
Synonym
Sulfonamid
Synonym
Azol
Synonym
4-Aminobenzene-1-sulfonamide
Synonym
NSC 7618
Synonym
(4-(Aminosulfonyl)phenyl)amine
Synonym
Sulfanilamide Vaginal Cream
Synonym
Ro 1-3354
Synonym
4-(Aminosulfonyl)aniline
Synonym
Streptocide
Synonym
Streptopan
Synonym
Infepan
Synonym
Tolder
Synonym
Sulfanidyl
Synonym
Exoseptoplix
Synonym
Streptocide (white)
Synonym
p-Sulfamoylaniline
Synonym
Streptocid
Synonym
4-Sulfamoylaniline
Synonym
Sulfonylamide
Synonym
Sulfonamide
Synonym
Sulphonamide
Synonym
A-349
Synonym
p-Aminophenylsulfonamide
Synonym
Dipron
Synonym
Sulfonamide P
Synonym
White streptocide
Synonym
Therapol
Synonym
Sulphanilamide
Synonym
Sulfocidine
Synonym
Sulfanil
Synonym
Sulfanalone
Synonym
Sulfana
Synonym
Sulfamine
Synonym
Sulfamidyl
Synonym
p-Sulfamidoaniline
Synonym
Streptozone
Synonym
Streptozol
Synonym
Streptosil
Synonym
Strepton
Synonym
Streptocom
Synonym
Streptoclase
Synonym
Streptocid album
Synonym
Streptasol
Synonym
Streptamid
Synonym
Streptagol
Synonym
Strepsan
Synonym
Strepamide
Synonym
Stramid
Synonym
Stopton Album
Synonym
Septoplix
Synonym
Septoplex
Synonym
Septolix
Synonym
Septinal
Synonym
Septanilam
Synonym
Septamide Album
Synonym
Sanamid
Synonym
Rubiazol A
Synonym
Pysococcine
Synonym
Proseptol
Synonym
Proseptine
Synonym
Proseptal
Synonym
Pronzin Album
Synonym
Prontylin
Synonym
Prontosil white
Synonym
Prontosil Album
Synonym
Prontosil I
Synonym
Prontalbin
Synonym
PABS
Synonym
Orgaseptine
Synonym
Neococcyl
Synonym
Lysococcine
Synonym
Lusil
Synonym
Gombardol
Synonym
Gerison
Synonym
Fourneau 1162
Synonym
Estreptocida
Synonym
Erysipan
Synonym
Ergaseptine
Synonym
Deseptyl
Synonym
Copticide
Synonym
Colsulanyde
Synonym
Collomide
Synonym
Bactesid
Synonym
Bacteramid
Synonym
Astrocid
Synonym
Astreptine
Synonym
Antistrept
Synonym
p-Anilinesulfonamide
Synonym
4-Aminophenylsulfonamide
Synonym
p-Aminobenzenesulfonamide
Synonym
Ambeside
Synonym
Albosal
Synonym
Albexan
Synonym
F 1162
Synonym
4-Aminobenzenesulfonamide
Synonym
Sulfanilamide
Synonym
Benzenesulfonamide, 4-amino-
Synonym
Identifiers:
SMILES:
Nc1ccc(S(N)(=O)=O)cc1
InChI:
InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 172.20900000000003 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 172.030648496 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 11 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 3 count | RDKit |
| Hydrogen Bond Donors | 2 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 1 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 1 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 86.18 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.08380000000000004 | RDKit |
| molecular_mass | 172.21 g/mol | Legacy Database |
| density | 1.08 g/cm³ | Legacy Database |
| cas-canonical-smile | O=S(=O)(N)C1=CC=C(N)C=C1 None | Legacy Database |
| cas-density | 1.08 g/cm3 @ Temp: 25 °C None | Legacy Database |
| cas-inchi | InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10) None | Legacy Database |
| cas-inchi-key | InChIKey=FDDDEECHVMSUSB-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | 165.5 °C None | Legacy Database |
| cas-name | Sulfanilamide None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 42.2276 | RDKit |