N-Methylsaccharin

C₈H₇NO₃SCAS 15448-99-4197.21 g/mol

Open in Covalent MOL file

Amide Lactam Sulfonamide

Properties

Molecular formula: C₈H₇NO₃S
Molar mass: 197.21 g/mol
Exact mass: 197.0147 Da
Melting point: 130 °C
logP: 0.46Crippen estimate
Polar surface area: 54.5 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 0

Identifiers

CAS number

15448-99-4

SMILES

CN1C(=O)c2ccccc2S1(=O)=O

InChIKey

DDIIAJRLFATEEE-UHFFFAOYSA-N

InChI

InChI=1S/C8H7NO3S/c1-9-8(10)6-4-2-3-5-7(6)13(9,11)12/h2-5H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names

1,2-Benzisothiazol-3(2H)-one, 2-methyl-, 1,1-dioxide
1,2-Benzisothiazolin-3-one, 2-methyl-, 1,1-dioxide
2-Methyl-1,2-benzisothiazolin-3-one 1,1-dioxide
N-Methylbenzoic sulfimide
NSC 39120
2-Methyl-1,2-benzisothiazol-3-one 1,1-dioxide
2-Methylbenzo[d]isothiazol-3(2H)-one 1,1-dioxide
2-Methyl-1,1-dioxo-1,2-dihydro-1λ*6*-benzo[d]isothiazol-3-one
2-Methylbenzo[d]isothiazol-3(2H)-one1,1-dioxide
2-Methyl-1,1-dioxo-1,2-benzothiazol-3-one
2-Methyl-2,3-dihydro-1λ6,2-benzothiazole-1,1,3-trione

Work with N-Methylsaccharin

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2-Methyl-4-hydroxy-2H-1,2-benzothiazine-3-carboxylic acid methyl ester 1,1-dioxide35511-15-052 % similar 4-Hydroxy-2-methyl-2H-1,2-benzothiazine-3-carboxylic acid ethyl ester 1,1-dioxide24683-26-949 % similar Piroxicam36322-90-444 % similar Meloxicam71125-38-740 % similar N-Isopropylphthalimide304-17-638 % similar 2-Ethyl-1H-isoindole-1,3(2H)-dione5022-29-738 % similar N-Aminophthalimide1875-48-537 % similar N-Bromophthalimide2439-85-237 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

P-Toluenesulfonyl isocyanate4083-64-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook