2-benzylsulfanylethyl pyridine-3-carboxylate

Modify Date: 2024-01-30 12:51:43

2-benzylsulfanylethyl pyridine-3-carboxylate Structure
2-benzylsulfanylethyl pyridine-3-carboxylate structure
Common Name 2-benzylsulfanylethyl pyridine-3-carboxylate
CAS Number 101952-53-8 Molecular Weight 273.35000
Density 1.197g/cm3 Boiling Point 415.4ºC at 760mmHg
Molecular Formula C15H15NO2S Melting Point N/A
MSDS N/A Flash Point 205ºC

 Names

Name 2-benzylsulfanylethyl pyridine-3-carboxylate

 Chemical & Physical Properties

Density 1.197g/cm3
Boiling Point 415.4ºC at 760mmHg
Molecular Formula C15H15NO2S
Molecular Weight 273.35000
Flash Point 205ºC
Exact Mass 273.08200
PSA 64.49000
LogP 3.17180
Vapour Pressure 4.13E-07mmHg at 25°C
Index of Refraction 1.597

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
QT0855000
CHEMICAL NAME :
Nicotinic acid, 2-(benzylthio)ethyl ester
CAS REGISTRY NUMBER :
101952-53-8
BEILSTEIN REFERENCE NO. :
0222719
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C15-H15-N-O2-S
MOLECULAR WEIGHT :
273.37
WISWESSER LINE NOTATION :
T6NJ CVO2S1R

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 :
250 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