3,7-Dihydro-7-(4-aminophenyl)-1,3-dimethyl-1H-purine-2,6-dione
Names
[ CAS No. ]:
963-48-4
[ Name ]:
3,7-Dihydro-7-(4-aminophenyl)-1,3-dimethyl-1H-purine-2,6-dione
[Synonym ]:
7-<p-Amino-phenyl>-theophyllin
7-<p-Amino-phenyl>-8-chlor-theophyllin
Chemical & Physical Properties
[ Density]:
1.48g/cm3
[ Boiling Point ]:
528.1ºC at 760 mmHg
[ Molecular Formula ]:
C13H13N5O2
[ Molecular Weight ]:
271.27500
[ Flash Point ]:
273.2ºC
[ Exact Mass ]:
271.10700
[ PSA ]:
87.84000
[ LogP ]:
0.58630
[ Index of Refraction ]:
1.728
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UO8409700
- CHEMICAL NAME :
- 1H-Purine-2,6-dione, 3,7-dihydro-7-(4-aminophenyl)-1,3-dimethyl-
- CAS REGISTRY NUMBER :
- 963-48-4
- BEILSTEIN REFERENCE NO. :
- 0562232
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C13-H13-N5-O2
- MOLECULAR WEIGHT :
- 271.31
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 75 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia, Italy) V.8-43 1953-88 For publisher information, see FRMCE8 Volume(issue)/page/year: 34,890,1979