Home Thiazoles 15448-99-4
15448-99-4,MFCD00059263
Catalog No.:AA003HLW
15448-99-4 | 2-Methylbenzo[d]isothiazol-3(2H);-one 1,1-dioxide
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1g
98%
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$60.00
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5g
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$180.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HLW
Chemical Name:
2-Methylbenzo[d]isothiazol-3(2H);-one 1,1-dioxide
CAS Number:
15448-99-4
Molecular Formula:
C8H7NO3S
Molecular Weight:
197.2111
MDL Number:
MFCD00059263
IUPAC Name:
2-methyl-1,1-dioxo-1,2-benzothiazol-3-one
InChI:
InChI=1S/C8H7NO3S/c1-9-8(10)6-4-2-3-5-7(6)13(9,11)12/h2-5H,1H3
InChI Key:
DDIIAJRLFATEEE-UHFFFAOYSA-N
SMILES:
O=C1c2ccccc2S(=O)(=O)N1C
EC Number:
239-466-7
UNII:
T63VBY3AYH
NSC Number:
39120
Properties
Computed Properties
 
Complexity:
330  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
197.208g/mol
Monoisotopic Mass:
197.015g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
62.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  

Synonyms
 
N-Methylsaccharin 
15448-99-4 
1,2-Benzisothiazol-3(2H)-one, 2-methyl-, 1,1-dioxide 
2-methyl-1,2-benzothiazol-3(2H)-one 1,1-dioxide 
Methylsaccharin 
NSC39120 
EINECS 239-466-7 
AI3-23674 
2-Methyl-1,1-dioxide 
AC1L1CWM 
SCHEMBL107126 
1,2-Benzisothiazolin-3-one, 2-methyl-, 1,1-dioxide 
2-Methylbenzo[d]isothiazol-3(2H)-one 1,1-dioxide 
CHEMBL131790 
1, 2-methyl-, 1,1-dioxide 
DTXSID10165639 
KS-000013ZW 
ZINC1671133 
7756AA 
BBL023072 
MFCD00059263 
NSC-39120 
RW3386 
UNII-T63VBY3AYH 
STL293362 
AKOS016011169 
DS-6404 
MCULE-4320541414 
AJ-29200 
AK121869 
CJ-27149 
DB-007773 
4CH-024790 
FT-0080407 
2-Methyl-1,2-benzisothiazol-3(2H)-one 1,1-dioxide 
FT-0650583 
H2468 
M0427 
ST24040887 
2-methyl-1,1-dioxo-benzo[d]isothiazol-3-one 
A20846 
1,2-Benzisothiazolin-3-one, 2-methyl-, 1,1-dioxide (8CI) 
2-Methyl-1,1-dioxo-1,2-dihydro-1lambda*6*-benzo[d]isothiazol-3-one 
Saccharin methylated 
C8H7NO3S 
NSC 39120 
C8-H7-N-O3-S 
CID27290 
2-Methylbenzo[d]isothiazol-3(2H)-one1,1-dioxide 
T63VBY3AYH 
2-methyl-1,1-dioxo-1,2-benzothiazol-3-one 
DDIIAJRLFATEEE-UHFFFAOYSA-N 
2-Methyl-1,2-benzisothiazole-3(2H)-one-1,1-dioxide 
Literature

Title: A 1:1 co-crystal of the herbicide triflusulfuron-methyl and its degradation product triazine amine.

Journal: Acta crystallographica. Section E, Structure reports online 20110901

Title: Sensitized photoxygenation of piroxicam in neat solvents and solvent mixtures.

Journal: Journal of photochemistry and photobiology. B, Biology 20011231

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