2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one
Names
[ CAS No. ]:
104715-80-2
[ Name ]:
2-(4-butylanilino)-9-(2-hydroxyethoxymethyl)-3H-purin-6-one
Chemical & Physical Properties
[ Density]:
1.34g/cm3
[ Boiling Point ]:
611.3ºC at 760mmHg
[ Molecular Formula ]:
C18H23N5O3
[ Molecular Weight ]:
357.40700
[ Flash Point ]:
323.5ºC
[ Exact Mass ]:
357.18000
[ PSA ]:
105.32000
[ LogP ]:
2.65750
[ Vapour Pressure ]:
8.5E-16mmHg at 25°C
[ Index of Refraction ]:
1.647
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UP0791780
- CHEMICAL NAME :
- 6H-Purin-6-one, 1,9-dihydro-2-((4-butylphenyl)amino)-9-((2-hydroxyeth oxy)methyl)-
- CAS REGISTRY NUMBER :
- 104715-80-2
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C18-H23-N5-O3
- MOLECULAR WEIGHT :
- 357.46
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
MUTATION DATA
- TYPE OF TEST :
- DNA inhibition
- TEST SYSTEM :
- Human HeLa cell
- DOSE/DURATION :
- 38 umol/L
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 30,109,1987
Synthetic Route
Related Compounds
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