1,2-Benzothiazolin-3-one, 6-methyl-

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Names

[ CAS No. ]:
4337-47-7

[ Name ]:
1,2-Benzothiazolin-3-one, 6-methyl-

[Synonym ]:
6-Methyl-1,2-benzisothiazolone
6-methyl-benzo[d]isothiazol-3-one
1,2-Benzothiazolin-3-one,6-methyl
6-methyl-1,2-benzothiazol-3(2h)-one
6-Methyl-3-oxo-2,3-dihydro-1,2-benzisothiazol
6-Methyl-1,2-benzisothiazolin-3-one
6-methylbenzisothiazol-3(2H)-one

Chemical & Physical Properties

[ Density]:
1.302g/cm3

[ Molecular Formula ]:
C8H7NOS

[ Molecular Weight ]:
165.21200

[ Exact Mass ]:
165.02500

[ PSA ]:
61.10000

[ LogP ]:
1.89800

[ Index of Refraction ]:
1.639

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DE4565000
CHEMICAL NAME :
1,2-Benzothiazolin-3-one, 6-methyl-
CAS REGISTRY NUMBER :
4337-47-7
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H7-N-O-S
MOLECULAR WEIGHT :
165.22
WISWESSER LINE NOTATION :
T56 BSMVJ H1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
510 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 14,1301,1964

Synthetic Route

Precursor & DownStream

Precursor

  • 2-bromo-4-methylbenzamide
  • Potassium thiocyanate

DownStream


Related Compounds

  • 6-Methyl-1,2-dihydro-3H-indazol-3-one
  • 9-methyl-1,2,3,4-tetrahydropyrido[2,1-b]quinazolin-11-one
  • Acesulfame potassium
  • 6-methyl-1,2,3,4-tetrahydro-7H-benz[a]anthracen-12-one
  • 6-methyl-1,2,3,4-tetrahydropyrido[2,1-b]quinazolin-11-one
  • 6-methyl-5-sulfanylidene-2H-1,2,4-triazin-3-one