3-Pyridinecarbonitrile, 1,4-dihydro-5-acetyl-6-methyl-2-(methylthio)-4-phenyl-
Names
[ CAS No. ]:
117509-71-4
[ Name ]:
3-Pyridinecarbonitrile, 1,4-dihydro-5-acetyl-6-methyl-2-(methylthio)-4-phenyl-
[Synonym ]:
hms2587a16
Chemical & Physical Properties
[ Density]:
1.21g/cm3
[ Boiling Point ]:
462.6ºC at 760mmHg
[ Molecular Formula ]:
C16H16N2OS
[ Molecular Weight ]:
284.37600
[ Flash Point ]:
233.5ºC
[ Exact Mass ]:
284.09800
[ PSA ]:
78.19000
[ LogP ]:
3.66338
[ Vapour Pressure ]:
9.77E-09mmHg at 25°C
[ Index of Refraction ]:
1.613
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- US4200800
- CHEMICAL NAME :
- 3-Pyridinecarbonitrile, 1,4-dihydro-5-acetyl-6-methyl-2-(methylthio)-4-phenyl -
- CAS REGISTRY NUMBER :
- 117509-71-4
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C16-H16-N2-O-S
- MOLECULAR WEIGHT :
- 284.40
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 :
- >1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- RPTOAN Russian Pharmacology and Toxicology (English Translation). Translation of FATOAO. (Euromed Pub., 33, Woodlands Rd., Surbiton, Surrey, UK) V.30- 1967- Volume(issue)/page/year: 51,191,1988