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

Related Compounds

  • 2-hydroxypropyl pyridine-3-carboxylate
  • 2-phenoxyethyl pyridine-3-carboxylate,hydrochloride
  • 2-aminobutyl pyridine-3-carboxylate,dihydrochloride
  • 2-ethylsulfanylethyl pyridine-3-carboxylate
  • 2-hexylsulfanylethyl pyridine-3-carboxylate
  • 2-cyclohexylsulfanylethyl pyridine-3-carboxylate
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 2-Amino-5-chloro-3-methoxybenzonitrile
  • 1-(2-Aminoethyl)cyclobutan-1-amine
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine