ACETONITRILE, (PURIN-6-YLTHIO)-
Names
[ CAS No. ]:
5443-91-4
[ Name ]:
ACETONITRILE, (PURIN-6-YLTHIO)-
[Synonym ]:
6-Cyanomethyl MP
6-cyanomethylthiopurine
Chemical & Physical Properties
[ Density]:
1.61g/cm3
[ Boiling Point ]:
371.4ºC at 760 mmHg
[ Molecular Formula ]:
C7H5N5S
[ Molecular Weight ]:
191.21300
[ Flash Point ]:
178.4ºC
[ Exact Mass ]:
191.02700
[ PSA ]:
103.55000
[ LogP ]:
0.96858
[ Index of Refraction ]:
1.822
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AM1990000
- CHEMICAL NAME :
- Acetonitrile, (purin-6-ylthio)-
- CAS REGISTRY NUMBER :
- 5443-91-4
- BEILSTEIN REFERENCE NO. :
- 0013487
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 2
- MOLECULAR FORMULA :
- C7-H5-N5-S
- MOLECULAR WEIGHT :
- 191.23
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 :
- 115 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. (Bethesda, MD 20205) Volume(issue)/page/year: JAN1986
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Parenteral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 85 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 71,618,1982