6-octylsulfanyl-7H-purine
Names
[ CAS No. ]:
6974-89-6
[ Name ]:
6-octylsulfanyl-7H-purine
[Synonym ]:
6-octylmercapto-7(9)H-purine
6-(Octylthio)-7H-purine
6-(octylthio)purine
Chemical & Physical Properties
[ Density]:
1.21g/cm3
[ Boiling Point ]:
383.6ºC at 760 mmHg
[ Molecular Formula ]:
C13H20N4S
[ Molecular Weight ]:
264.39000
[ Flash Point ]:
185.8ºC
[ Exact Mass ]:
264.14100
[ PSA ]:
79.76000
[ LogP ]:
3.80550
[ Index of Refraction ]:
1.628
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- UO9035000
- CHEMICAL NAME :
- Purine, 6-(octylthio)-
- CAS REGISTRY NUMBER :
- 6974-89-6
- BEILSTEIN REFERENCE NO. :
- 0019439
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C13-H20-N4-S
- MOLECULAR WEIGHT :
- 264.43
- WISWESSER LINE NOTATION :
- T56 BM DN FN HNJ IS8
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 :
- 180 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#03052