Anethole trithione

Modify Date: 2024-01-02 19:21:35

Anethole trithione structure	Common Name	Anethole trithione
	CAS Number	532-11-6	Molecular Weight	240.365
	Density	1.4±0.1 g/cm3	Boiling Point	398.1±52.0 °C at 760 mmHg
	Molecular Formula	C₁₀H₈OS₃	Melting Point	23 C
	MSDS	N/A	Flash Point	194.6±30.7 °C

Use of Anethole trithione

Anethole trithione is a drug used in the treatment of dry mouth， being studied in the treatment of cancer.

Name	5-(4-methoxyphenyl)dithiole-3-thione
Synonym	More Synonyms

Description	Anethole trithione is a drug used in the treatment of dry mouth， being studied in the treatment of cancer.
Related Catalog	Signaling Pathways >> Others >> Others Research Areas >> Cancer

Density	1.4±0.1 g/cm3
Boiling Point	398.1±52.0 °C at 760 mmHg
Melting Point	23 C
Molecular Formula	C₁₀H₈OS₃
Molecular Weight	240.365
Flash Point	194.6±30.7 °C
Exact Mass	239.973724
PSA	105.50000
LogP	3.39
Vapour Pressure	0.0±0.9 mmHg at 25°C
Index of Refraction	1.732

CHEMICAL IDENTIFICATION

RTECS NUMBER :: JP1292500

CHEMICAL NAME :: 3H-1,2-Dithiole-3-thione, 5-(p-methoxyphenyl)-

CAS REGISTRY NUMBER :: 532-11-6

BEILSTEIN REFERENCE NO. :: 0158393

LAST UPDATED :: 199612

DATA ITEMS CITED :: 6

MOLECULAR FORMULA :: C10-H8-O-S3

MOLECULAR WEIGHT :: 240.36

WISWESSER LINE NOTATION :: T5SSYTJ CUS ER DO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: >2 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: IYKEDH Iyakuhin Kenkyu. Study of Medical Supplies. (Nippon Koteisho Kyokai, 12-15, 2-chome, Shibuya, Shibuya-ku, Tokyo 150, Japan) V.1- 1970- Volume(issue)/page/year: 25,815,1994

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intramuscular

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 35 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: AEPPAE Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. (Berlin, Ger.) V.110-253, 1925-66. For publisher information, see NSAPCC. Volume(issue)/page/year: 222,244,1954

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1480 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: -,38,1990

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1780 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,25,1982

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 6 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: NIIRDN Drugs in Japan (Ethical Drugs). (Yakugyo Jiho Co., Ltd., Tokyo, Japan) Volume(issue)/page/year: 6,25,1982 ** OTHER MULTIPLE DOSE TOXICITY DATA **

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 8640 mg/kg/24W-I

TOXIC EFFECTS :: Liver - changes in liver weight Endocrine - changes in adrenal weight Blood - changes in serum composition (e.g. TP, bilirubin, cholesterol)

REFERENCE :: OYYAA2 Oyo Yakuri. Pharmacometrics. (Oyo Yakuri Kenkyukai, CPO Box 180, Sendai 980-91, Japan) V.1- 1967- Volume(issue)/page/year: 12,79,1976

Hazard Codes	Xi
HS Code	2930909090

cis-Anethol

CAS#:104-46-1

Anethole trithione

CAS#:532-11-6

Literature: EP1980559 A1, ; Page/Page column 9 ; EP 1980559 A1

trans-Anethole

CAS#:4180-23-8

Anethole trithione

CAS#:532-11-6

Literature: Justus Liebigs Annalen der Chemie, , vol. 557, p. 89,105 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, , vol. 224, p. 479

Carbon disulphide

CAS#:75-15-0

Acetanisole

CAS#:100-06-1

~89%

Anethole trithione

CAS#:532-11-6

Literature: Curphey; Libby Tetrahedron Letters, 2000 , vol. 41, # 36 p. 6977 - 6980

(Z)-anethol

CAS#:25679-28-1

Anethole trithione

CAS#:532-11-6

Literature: EP1645288 A1, ; Page/Page column 5 ;

Estragole

CAS#:140-67-0

Anethole trithione

CAS#:532-11-6

Literature: Justus Liebigs Annalen der Chemie, , vol. 557, p. 89,105

trans-Anethole

CAS#:4180-23-8

Anethole trithione

CAS#:532-11-6

2,5-bis-(4-meth...

CAS#:77150-78-8

Literature: Justus Liebigs Annalen der Chemie, , vol. 557, p. 89,105 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, , vol. 224, p. 479

5-(p-methoxyphe...

CAS#:831-30-1

Anethole trithione

CAS#:532-11-6

Literature: Justus Liebigs Annalen der Chemie, , vol. 568, p. 227,237

3,3-dimercapto-...

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Anethole trithione

CAS#:532-11-6

Literature: Bulletin de la Societe Chimique de France, , p. 1398,1400

Acetanisole

CAS#:100-06-1

Anethole trithione

CAS#:532-11-6

Literature: Bulletin de la Societe Chimique de France, , p. 1398,1400

Precursor 8
CAS#:104-46-1 cis-Anethol CAS#:4180-23-8 trans-Anethole CAS#:75-15-0 Carbon disulphide CAS#:100-06-1 Acetanisole
CAS#:25679-28-1 (Z)-anethol CAS#:140-67-0 Estragole CAS#:831-30-1 5-(p-methoxyphe... CAS#:50849-98-4 3,3-dimercapto-...
DownStream 7
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