8-(Cycloheptyloxy)caffeine

Modify Date: 2024-04-03 16:18:03

8-(Cycloheptyloxy)caffeine Structure
8-(Cycloheptyloxy)caffeine structure
Common Name 8-(Cycloheptyloxy)caffeine
CAS Number 73747-31-6 Molecular Weight 306.36000
Density 1.36g/cm3 Boiling Point 483.7ºC at 760 mmHg
Molecular Formula C15H22N4O3 Melting Point N/A
MSDS N/A Flash Point 246.3ºC

 Names

Name 8-cycloheptyloxy-1,3,7-trimethylpurine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.36g/cm3
Boiling Point 483.7ºC at 760 mmHg
Molecular Formula C15H22N4O3
Molecular Weight 306.36000
Flash Point 246.3ºC
Exact Mass 306.16900
PSA 71.05000
LogP 1.07230
Index of Refraction 1.647

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
EV6496000
CHEMICAL NAME :
Caffeine, 8-(cycloheptyloxy)-
CAS REGISTRY NUMBER :
73747-31-6
LAST UPDATED :
197903
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H22-N4-O3
MOLECULAR WEIGHT :
306.41
WISWESSER LINE NOTATION :
T56 BN DN FNVNVJ B1 F1 H1 CO- AL7TJ

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 :
32 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#06881

 Synonyms

1H-Purine-2,6-dione,8-(cycloheptyloxy)-3,7-dihydro-1,3,7-trimethyl
8-(Cycloheptyloxy)caffeine
CAFFEINE,8-(CYCLOHEPTYLOXY)