1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-, hydriodide (1:1)
Names
[ CAS No. ]:
17186-95-7
[ Name ]:
1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-, hydriodide (1:1)
[Synonym ]:
Theobromine,monohydriodide
Theobromide hydroiodide
3,7-Dimethylxanthine hydriodide
Chemical & Physical Properties
[ Density]:
1.6g/cm3
[ Molecular Formula ]:
C7H9IN4O2
[ Molecular Weight ]:
308.07600
[ Exact Mass ]:
307.97700
[ PSA ]:
72.68000
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- XH2471000
- CHEMICAL NAME :
- Theobromine, monohydriodide
- CAS REGISTRY NUMBER :
- 17186-95-7
- LAST UPDATED :
- 197901
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C7-H7-N4-O2.H-I
- MOLECULAR WEIGHT :
- 307.09
- WISWESSER LINE NOTATION :
- T56 BN DN FNVNVJ B1 F1 H1 &IH
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 :
- 320 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#02979