Products Categories
| CAS No.: | 106917-52-6 |
|---|---|
| Name: | FLUSULFAMIDE |
| Molecular Structure: | |
|
|
|
| Formula: | C13H7Cl2F3N2O4S |
| Molecular Weight: | 415.177 |
| Synonyms: | 3-Trifluoromethyl-4-chlorobenzenesulfone-2-chloro-4-nitroanilide;Flusulfamide;MTF 651; |
| Density: | 1.675 g/cm3 |
| Melting Point: | 168～173℃ |
| Boiling Point: | 498.2 °C at 760 mmHg |
| Flash Point: | 255.1 °C |
| Solubility: | Water - 2.9mg/kg at 25°C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | Xi:; ">  Xi:; |
| PSA: | 100.37000 |
| LogP: | 6.39820 |
- 144851-82-1METHYL2-AMINO-3-FLUOROBENZOATE
- 483366-12-7(2S,4R)-1-Boc-2-cyano-4-hydroxypyrrolidine
- 173606-50-3BOC-10-AMINODECANOIC ACID
- 361456-36-2METHYL (R)-(+)-ISOCYANATO-3-PHENYLPROPI&
- 5156-58-1N-(1-Benzyl-4-pipperidinyl)-N-phenylpropanamide HCl
- 81281-59-67-Benzylideneaminotheophylline
- 50288-62-5threo-Phenyl-2-piperidyl acetamide
- 82993-81-5D-threo-Ritalinic acid hydrochloride
- 47087-37-6Z-D-Glu-OMe
- 1219080-61-1IMIDAZOLE-2-BORONIC ACID
What can I do for you?
Get Best Price
Specification
The Flusulfamide with the CAS number 106917-52-6 is also called Benzenesulfonamide,4-chloro-N-(2-chloro-4-nitrophenyl)-3-(trifluoromethyl)-. Both the systematic name and IUPAC name are 4-chloro-N-(2-chloro-4-nitrophenyl)-3-(trifluoromethyl)
benzenesulfonamide. Its molecular formula is C13H7Cl2F3N2O4S. This chemical should stored at 0-6°C.
The properties of the chemical are: (1)ACD/LogP: 5.73; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.68; (4)ACD/LogD (pH 7.4): 4.75; (5)ACD/BCF (pH 5.5): 11927.25; (6)ACD/BCF (pH 7.4): 1399.47; (7)ACD/KOC (pH 5.5): 27918.46; (8)ACD/KOC (pH 7.4): 3275.77; (9)#H bond acceptors: 6; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 91.58 Å2; (13)Index of Refraction: 1.598; (14)Molar Refractivity: 84.6 cm3; (15)Molar Volume: 247.8 cm3; (16)Polarizability: 33.54×10-24cm3; (17)Surface Tension: 56.2 dyne/cm; (18)Enthalpy of Vaporization: 76.64 kJ/mol; (19)Vapour Pressure: 4.62×10-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2cc(ccc2NS(=O)(=O)c1ccc(Cl)c(c1)C(F)(F)F)[N+]([O-])=O
(2)InChI: InChI=1/C13H7Cl2F3N2O4S/c14-10-3-2-8(6-9(10)13(16,17)18)25(23,24)19-12-4-1-7(20(21)22)5-11(12)15/h1-6,19H
(3)InChIKey: GNVDAZSPJWCIQZ-UHFFFAOYAG
The toxicity data is as follows:
| Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
|---|---|---|---|---|---|
| mouse | LD50 | oral | 245mg/kg (245mg/kg) | Pesticide Manual. Vol. 9, Pg. 425, 1991. | |
| rat | LC50 | inhalation | 470mg/m3 (470mg/m3) | Agrochemcicals Japan. Vol. (65), Pg. 17, 1994. | |
| rat | LD50 | oral | 132mg/kg (132mg/kg) | Pesticide Manual. Vol. 9, Pg. 425, 1991. | |
| rat | LD50 | skin | > 2gm/kg (2000mg/kg) | Pesticide Manual. Vol. 9, Pg. 425, 1991. |