73747-33-8

73747-33-8 structure
73747-33-8 structure
  • Name: 8-cyclopentyloxy-1,3,7-trimethyl-purine-2,6-dione
  • Chemical Name: 8-cyclopentyloxy-1,3,7-trimethylpurine-2,6-dione
  • CAS Number: 73747-33-8
  • Molecular Formula: C13H18N4O3
  • Molecular Weight: 278.30700
  • Create Date: 2016-10-15 01:44:30
  • Modify Date: 2024-10-22 12:11:56

Name 8-cyclopentyloxy-1,3,7-trimethylpurine-2,6-dione
Synonyms 8-(Cyclopentyloxy)caffeine
CAFFEINE,8-(CYCLOPENTYLOXY)
1H-Purine-2,6-dione,8-(cyclopentyloxy)-3,7-dihydro-1,3,7-trimethyl
Density 1.45g/cm3
Boiling Point 461ºC at 760 mmHg
Molecular Formula C13H18N4O3
Molecular Weight 278.30700
Flash Point 232.6ºC
Exact Mass 278.13800
PSA 71.05000
LogP 0.29210
Index of Refraction 1.676

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EV6498000
CHEMICAL NAME :
Caffeine, 8-(cyclopentyloxy)-
CAS REGISTRY NUMBER :
73747-33-8
LAST UPDATED :
197903
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H18-N4-O3
MOLECULAR WEIGHT :
278.35
WISWESSER LINE NOTATION :
T56 BN DN FNVNVJ B1 F1 H1 CO- AL5TJ

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#06880