2-phenylsulfanylethyl pyridine-3-carboxylate
Names
[ CAS No. ]:
101952-72-1
[ Name ]:
2-phenylsulfanylethyl pyridine-3-carboxylate
Chemical & Physical Properties
[ Density]:
1.23g/cm3
[ Boiling Point ]:
402.6ºC at 760mmHg
[ Molecular Formula ]:
C14H13NO2S
[ Molecular Weight ]:
259.32400
[ Flash Point ]:
197.3ºC
[ Exact Mass ]:
259.06700
[ PSA ]:
64.49000
[ LogP ]:
3.03070
[ Vapour Pressure ]:
1.08E-06mmHg at 25°C
[ Index of Refraction ]:
1.612
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- QT1996000
- CHEMICAL NAME :
- Nicotinic acid, 2-(phenylthio)ethyl ester
- CAS REGISTRY NUMBER :
- 101952-72-1
- BEILSTEIN REFERENCE NO. :
- 0206211
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C14-H13-N-O2-S
- MOLECULAR WEIGHT :
- 259.34
- WISWESSER LINE NOTATION :
- T6NJ CVO2SR
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 :
- 100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- PHARAT Pharmazie. (VEB Verlag Volk und Gesundheit, Neue Gruenstr. 18, Berlin DDR-1020, Ger. Dem. Rep.) V.1- 1946- Volume(issue)/page/year: 11,242,1956