8-thia-7,9-diazabicyclo[4.3.0]nona-2,4,6,9-tetraen-3-ylmethylsulfanylmethanimidamide

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Names

[ CAS No. ]:
65858-52-8

[ Name ]:
8-thia-7,9-diazabicyclo[4.3.0]nona-2,4,6,9-tetraen-3-ylmethylsulfanylmethanimidamide

[Synonym ]:
2,1,3-benzothiadiazol-5-ylmethyl carbamimidothioate hydrobromide
Carbamimidothioic acid,2,1,3-benzothiadiazol-5-ylmethyl ester,monohydrobromide

Chemical & Physical Properties

[ Density]:
1.64g/cm3

[ Boiling Point ]:
382.4ºC at 760 mmHg

[ Molecular Formula ]:
C8H9BrN4S2

[ Molecular Weight ]:
305.21800

[ Flash Point ]:
185.1ºC

[ Exact Mass ]:
303.94500

[ PSA ]:
129.19000

[ LogP ]:
3.57610

[ Index of Refraction ]:
1.829

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
FD3065500
CHEMICAL NAME :
Carbamimidothioic acid, 2,1,3-benzothiadiazol-5-ylmethyl ester, monohydrobromide
CAS REGISTRY NUMBER :
65858-52-8
LAST UPDATED :
199603
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H8-N4-S2.Br-H
MOLECULAR WEIGHT :
305.24

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Unreported
SPECIES OBSERVED :
Mammal - species unspecified
DOSE/DURATION :
75 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 15,968,1977

Related Compounds

  • Benzyl 3-[(chlorosulfonyl)methyl]-8-fluoro-1,2,3,4-tetrahydroquinoline-1-carboxylate
  • 2-[(3-chlorothiophen-2-yl)methyl]-2H-1,2,3-triazol-4-amine
  • 5-Bromo-N-(4,5-dihydro-1H-imidazol-2-yl)-2-pyridinamine
  • 1-(2-Aminohexan-2-yl)-4,4-dimethylcyclohexan-1-ol
  • 3-Pentenoic acid, 2,5-diamino-, 1,1-dimethylethyl ester
  • 6-(3-Methoxypiperidin-1-yl)spiro[4.5]decan-8-ol
  • 1-(1-Amino-3,3-dimethylcyclobutyl)-4,4-dimethylcyclohexan-1-ol
  • tert-butyl N-[1-(5-fluoro-2-methoxy-4-methylphenyl)-2-oxoethyl]-N-methylcarbamate
  • tert-butyl N-{5-[1-(aminomethyl)-3-hydroxycyclobutyl]-4-methyl-1,3-thiazol-2-yl}carbamate
  • 3-Methyl-2-[2-(methylsulfanyl)phenyl]butanoic acid
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