Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 6-Thio-(8-ethylthio)theophylline
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
Stocking Period: Inquiry
Contact: Ms Wang

4791-35-9

4791-35-9 structure

4791-35-9 structure

Name: 6-Thio-(8-ethylthio)theophylline
Chemical Name: 8-ethylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
CAS Number: 4791-35-9
Molecular Formula: C₉H₁₂N₄OS₂
Molecular Weight: 256.34800
Create Date: 2017-03-06 01:57:39
Modify Date: 2024-01-27 14:38:44

Name	8-ethylsulfanyl-1,3-dimethyl-6-sulfanylidene-7H-purin-2-one
Synonyms	Uric acid,1,3-dimethyl-8-ethylthio-6-thio 8-ethylsulfanyl-1,3-dimethyl-6-thioxo-1,3,6,7(9)-tetrahydro-purin-2-one 6-Thio-(8-ethylthio)theophylline 8-Ethylthio-6-thiotheophyllin Theophylline,8-ethylthio-6-thio

Density	1.49g/cm3
Boiling Point	467.6ºC at 760 mmHg
Molecular Formula	C₉H₁₂N₄OS₂
Molecular Weight	256.34800
Flash Point	236.6ºC
Exact Mass	256.04500
PSA	113.00000
LogP	1.44160
Index of Refraction	1.715

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH5623000

CHEMICAL NAME :: Theophylline, 8-ethylthio-6-thio-

CAS REGISTRY NUMBER :: 4791-35-9

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C9-H12-N4-O-S2

MOLECULAR WEIGHT :: 256.37

WISWESSER LINE NOTATION :: T56 BM DN FNVNYJ CS2 F1 H1 IUS

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 180 mg/kg

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

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04421