2H-1,3,5-Thiadiazine-2-thione,5-butyltetrahydro-3-(phenylmethyl)-

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Names

[ CAS No. ]:
21808-80-0

[ Name ]:
2H-1,3,5-Thiadiazine-2-thione,5-butyltetrahydro-3-(phenylmethyl)-

[Synonym ]:
2-Thioxo-5-butyl-3-benzyl-tetrahydro-1,3,5-thiadiazin
2-Thio-3-benzyl-5-butyl-tetrahydro-1,3,5-thiadiazin
2H-1,3,5-Thiadiazine-2-thione,tetrahydro-3-benzyl-5-butyl

Chemical & Physical Properties

[ Density]:
1.19g/cm3

[ Boiling Point ]:
397.8ºC at 760mmHg

[ Molecular Formula ]:
C14H20N2S2

[ Molecular Weight ]:
280.45200

[ Flash Point ]:
194.4ºC

[ Exact Mass ]:
280.10700

[ PSA ]:
63.87000

[ LogP ]:
3.41320

[ Vapour Pressure ]:
1.54E-06mmHg at 25°C

[ Index of Refraction ]:
1.64

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XI2737000
CHEMICAL NAME :
2H-1,3,5-Thiadiazine-2-thione, tetrahydro-5-butyl-3-(phenylmethyl)-
CAS REGISTRY NUMBER :
21808-80-0
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C14-H20-N2-S2
MOLECULAR WEIGHT :
280.48

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>500 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: 19,558,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>500 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: 21,121,1971

Synthetic Route

Precursor & DownStream

Precursor

  • Carbon disulphide
  • Formaldehyde
  • n-butylamine
  • Benzylamine

DownStream


Related Compounds

  • 2-chloro-N-(4-pyridin-4-yl-thiazol-2-yl)-acetamide
  • 3-((1-Methylpiperidin-4-yl)oxy)propanoic acid
  • 5-((Tert-butyldimethylsilyl)oxy)-2-fluorobenzoic acid
  • Ethanone, 1-[2-(chloromethyl)cyclopropyl]-, trans-
  • 5-Chloro-5-deoxy-I(2)-D-ribofuranose
  • Isopropyl 3-amino-4-(3-bromophenylamino)benzoate
  • 3-(Chloromethyl)-1-ethyl-5-methyl-1H-1,2,4-triazole
  • Spiro[5.5]undecane-2-carboxylic acid
  • tert-butyl 4-(5-bromo-1H-indazol-1-yl)piperidine-1-carboxylate
  • 3-[2-(2-Chloroethoxy)ethoxy]prop-1-yne
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