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6466-20-2

6466-20-2 structure
6466-20-2 structure

Name 1,3-dimethyl-8-methylsulfanyl-7H-purine-2,6-dithione
Synonyms Uric acid,1,3-dimethyl-2,6-dithio-8-methylthio
Theophylline,2,6-dithio-8-methylthio
2,6-Dithio-8-methyltheophylline
Theophylline,8-(methylthio)dithio
Density 1.58g/cm3
Boiling Point 465.7ºC at 760mmHg
Molecular Formula C8H10N4S3
Molecular Weight 258.38700
Flash Point 235.5ºC
Exact Mass 258.00700
PSA 128.02000
LogP 2.42080
Index of Refraction 1.799

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH5155000
CHEMICAL NAME :
Theophylline, 2,6-dithio-8-methylthio-
CAS REGISTRY NUMBER :
6466-20-2
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H10-N4-S3
MOLECULAR WEIGHT :
258.40
WISWESSER LINE NOTATION :
T56 BM DN FNYNYJ CS1 F1 GUS 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 :
56 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#04442
HS Code 2933990090
HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%