2-phenylsulfanylethyl pyridine-3-carboxylate

Modify Date: 2024-09-16 18:30:10

2-phenylsulfanylethyl pyridine-3-carboxylate Structure
2-phenylsulfanylethyl pyridine-3-carboxylate structure
Common Name 2-phenylsulfanylethyl pyridine-3-carboxylate
CAS Number 101952-72-1 Molecular Weight 259.32400
Density 1.23g/cm3 Boiling Point 402.6ºC at 760mmHg
Molecular Formula C14H13NO2S Melting Point N/A
MSDS N/A Flash Point 197.3ºC

 Names

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
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