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| CAS No.: | 53297-68-0 |
|---|---|
| Name: | 2-CHLORO-4-SULFAMOYLANILINE |
| Article Data: | 8 |
| Cas Database | |
| Molecular Structure: | |
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| Formula: | C6H7ClN2O2S |
| Molecular Weight: | 206.653 |
| Synonyms: | Sulfanilamide,3-chloro- (6CI);2-Chloro-4-sulfamoylaniline;4-Amino-3-chlorobenzenesulfonamide; |
| Density: | 1.558 g/cm3 |
| Melting Point: | 161 °C |
| Boiling Point: | 414.4 °C at 760 mmHg |
| Flash Point: | 204.4 °C |
| PSA: | 94.56000 |
| LogP: | 2.93190 |
- 53297-70-4Benzenesulfonamide,4-amino-3-methyl-
- 5329-79-32-Hexanamine
- 53298-30-9Carbonic acid,2-(methylsulfonyl)ethyl 4-nitrophenyl ester
- 53298-33-2L-Cysteine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-S-(phenylmethyl)-
- 5329-93-13-Propan-2-yloxypropanenitrile
- 533-00-6Benzoic acid, bariumsalt (2:1)
- 5330-38-1Benzenemethanol,5-chloro-2-hydroxy-
- 53304-32-87H-Benzimidazo[2,1-a]benzo[3,4][2]benzothiopyrano[7,8,1-def]isoquinolin-7-one
- 5330-52-9(4,5-Dibromo-2-nitro-cyclohexyl)benzene
- 5330-53-04-[N-(5-diethylaminopentan-2-yl)-C-(4-dimethylaminophenyl)carbonimidoyl]-N,N-dimethyl-aniline; 2-hydroxypropane-1,2,3-tricarboxylic acid
- Total:28 Page 1 of 1 1
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Specification
The CAS registry number of Benzenesulfonamide,4-amino-3-chloro- is 53297-68-0. It belongs to the product category of Pharmacetical. This chemical is also named as 2-Chloro-4-sulfamoylaniline. In addition, its molecular formula is C6H7ClN2O2S and molecular weight is 206.65. Its systematic name and IUPAC name are the same which is called 4-amino-3-chlorobenzenesulfonamide.
Physical properties about Benzenesulfonamide,4-amino-3-chloro- are: (1)ACD/LogP: 0.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.62; (4)ACD/LogD (pH 7.4): 0.62; (5)ACD/BCF (pH 5.5): 1.75; (6)ACD/BCF (pH 7.4): 1.75; (7)ACD/KOC (pH 5.5): 51.94; (8)ACD/KOC (pH 7.4): 51.84; (9)#H bond acceptors: 4; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.637; (13)Molar Refractivity: 47.63 cm3; (14)Molar Volume: 132.6 cm3; (15)Surface Tension: 66 dyne/cm; (16)Density: 1.558 g/cm3; (17)Flash Point: 204.4 °C; (18)Enthalpy of Vaporization: 66.73 kJ/mol; (19)Boiling Point: 414.4 °C at 760 mmHg.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(ccc1N)S(=O)(=O)N
(2)InChI: InChI=1/C6H7ClN2O2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,8H2,(H2,9,10,11)
(3)InChIKey: LFIOFZKZCDMGFG-UHFFFAOYAM
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | 2950mg/kg (2950mg/kg) | BEHAVIORAL: ATAXIA GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA" | Arzneimittel-Forschung. Drug Research. Vol. 28, Pg. 1331, 1978. Link to PubMed |