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

Modify Date: 2024-01-08 10:29:17

2H-1,3,5-Thiadiazine-2-thione,5-butyltetrahydro-3-(phenylmethyl)- Structure
2H-1,3,5-Thiadiazine-2-thione,5-butyltetrahydro-3-(phenylmethyl)- structure
Common Name 2H-1,3,5-Thiadiazine-2-thione,5-butyltetrahydro-3-(phenylmethyl)-
CAS Number 21808-80-0 Molecular Weight 280.45200
Density 1.19g/cm3 Boiling Point 397.8ºC at 760mmHg
Molecular Formula C14H20N2S2 Melting Point N/A
MSDS N/A Flash Point 194.4ºC

 Names

Name 3-benzyl-5-butyl-1,3,5-thiadiazinane-2-thione
Synonym More Synonyms

 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

~%

Detail
Literature: Shah,I.D.; Trivedi,J.P. Journal of the Indian Chemical Society, 1964 , vol. 41, p. 225 - 227

 Synonyms

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
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