Welcome to LookChem.com Sign In|Join Free
  • or
Home > Products >  > 

6-Nitro-1,2-benzisothiazolin-3-one 1,1-dioxide

Related Products

Hot Products

Name

6-Nitro-1,2-benzisothiazolin-3-one 1,1-dioxide

EINECS N/A
CAS No. 22952-24-5 Density 1.762 g/cm3
PSA 117.44000 LogP 1.95970
Solubility N/A Melting Point 205-207 °C
Formula C7H4N2O5S Boiling Point N/A
Molecular Weight 228.185 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 22952-24-5 (6-Nitro-1,2-benzisothiazolin-3-one 1,1-dioxide) Hazard Symbols N/A
Synonyms

1,2-Benzisothiazolin-3-one,6-nitro-, 1,1-dioxide (6CI,7CI,8CI);Saccharin, 6-nitro- (4CI);6-Nitro-1,2-benzisothiazol-3-one1,1-dioxide;6-Nitro-1,2-benzoisothiazolin-3-one 1,1-dioxide;6-Nitrosaccharin;NSC 358278;

Article Data 21

6-Nitro-1,2-benzisothiazolin-3-one 1,1-dioxide Specification

The CAS register number of 6-Nitro-1,2-benzisothiazolin-3-one 1,1-dioxide is 22952-24-5. It also can be called as 6-Nitro-1,2-benzisothiazol-3(2H)-one 1,1-dioxide and the IUPAC name about this chemical is 6-nitro-1,1-dioxo-1,2-benzothiazol-3-one.

Physical properties about 6-Nitro-1,2-benzisothiazolin-3-one 1,1-dioxide are: (1)ACD/LogP: 0.64; (2)ACD/LogD (pH 5.5): -1.36; (3)ACD/LogD (pH 7.4): -1.36; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 1; (8)#H bond acceptors: 7; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 108.65Å2; (12)Index of Refraction: 1.662; (13)Molar Refractivity: 47.95 cm3; (14)Molar Volume: 129.4 cm3; (15)Polarizability: 19x10-24cm3; (16)Surface Tension: 76.2 dyne/cm.

Preparation: this chemical can be prepared by 4-nitro-toluene-2-sulfonic acid amide. This reaction will need reagent aqueous Na2Cr2O7, concentrated H2SO4.

Uses of 6-Nitro-1,2-benzisothiazolin-3-one 1,1-dioxide: it can be used to produce 6-amino-1,1-dioxo-1l6-benz[d]isothiazol-3-one at heating. This reaction will need reagent cyclohexene, catalyst 5percent Pd/C and solvent ethanol with reaction time of 2 hours. The yield is about 63%.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c1ccc2c(c1)S(=O)(=O)NC2=O
(2)InChI: InChI=1/C7H4N2O5S/c10-7-5-2-1-4(9(11)12)3-6(5)15(13,14)8-7/h1-3H,(H,8,10)
(3)InChIKey: HZZFBUZSKAVIOV-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C7H4N2O5S/c10-7-5-2-1-4(9(11)12)3-6(5)15(13,14)8-7/h1-3H,(H,8,10)
(5)Std. InChIKey: HZZFBUZSKAVIOV-UHFFFAOYSA-N

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 22952-24-5