Theophylline, 8-cinnamyl
Names
[ CAS No. ]:
74039-67-1
[ Name ]:
Theophylline, 8-cinnamyl
Chemical & Physical Properties
[ Density]:
1.319g/cm3
[ Boiling Point ]:
579.3ºC at 760 mmHg
[ Molecular Formula ]:
C16H16N4O2
[ Molecular Weight ]:
296.32400
[ Flash Point ]:
304.2ºC
[ Exact Mass ]:
296.12700
[ PSA ]:
72.68000
[ LogP ]:
1.21620
[ Index of Refraction ]:
1.666
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XH5093200
- CHEMICAL NAME :
- Theophylline, 8-cinnamyl-
- CAS REGISTRY NUMBER :
- 74039-67-1
- BEILSTEIN REFERENCE NO. :
- 0035201
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C16-H16-N4-O2
- MOLECULAR WEIGHT :
- 296.36
- WISWESSER LINE NOTATION :
- T56 BM DN FNVNVJ C2U1R& 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 :
- 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#04469