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4989-72-4

4989-72-4 structure
4989-72-4 structure
  • Name: Uric acid, 1,3-dimethyl-8-ethylthio-2-thio-
  • Chemical Name: 8-ethylsulfanyl-1,3-dimethyl-2-sulfanylidene-7H-purin-6-one
  • CAS Number: 4989-72-4
  • Molecular Formula: C9H12N4OS2
  • Molecular Weight: 256.34800
  • Create Date: 2016-10-01 09:56:14
  • Modify Date: 2024-04-11 17:40:36

Name 8-ethylsulfanyl-1,3-dimethyl-2-sulfanylidene-7H-purin-6-one
Synonyms 8-Ethylthio-2-thiotheophyllin
Uric acid,1,3-dimethyl-8-ethylthio-2-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 :
XH5622000
CHEMICAL NAME :
Theophylline, 8-ethylthio-2-thio-
CAS REGISTRY NUMBER :
4989-72-4
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H12-N4-O-S2
MOLECULAR WEIGHT :
256.37
WISWESSER LINE NOTATION :
T56 BM DN FNYNVJ CS2 F1 GUS H1

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 :
10 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#04423