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73908-75-5

73908-75-5 structure
73908-75-5 structure
  • Name: 8-heptylsulfanyl-1,3-dimethyl-7H-purine-2,6-dione
  • Chemical Name: Theophylline, (8-heptylthio)
  • CAS Number: 73908-75-5
  • Molecular Formula: C14H22N4O2S
  • Molecular Weight: 310.41500
  • Create Date: 2016-09-29 19:23:05
  • Modify Date: 2024-02-05 16:10:40

Name Theophylline, (8-heptylthio)
Synonyms 8-Heptylthiotheophyline
Density 1.27g/cm3
Boiling Point 502ºC at 760 mmHg
Molecular Formula C14H22N4O2S
Molecular Weight 310.41500
Flash Point 257.4ºC
Exact Mass 310.14600
PSA 97.98000
LogP 2.02280
Index of Refraction 1.598

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH5635000
CHEMICAL NAME :
Theophylline, 8-heptylthio-
CAS REGISTRY NUMBER :
73908-75-5
LAST UPDATED :
197901
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H22-N4-O2-S
MOLECULAR WEIGHT :
310.46
WISWESSER LINE NOTATION :
T56 BM DN FNVNVJ CS7 F1 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 :
100 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#04407