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Benzyl nicotinate

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Benzyl nicotinate

EINECS 202-332-3
CAS No. 94-44-0 Density 1.176 g/cm3
PSA 39.19000 LogP 2.43860
Solubility N/A Melting Point 24 °C(lit.)
Formula C13H11NO2 Boiling Point 334.1 °C at 760 mmHg
Molecular Weight 213.236 Flash Point 155.8 °C
Transport Information N/A Appearance yellow liquid
Safety 26 Risk Codes 36/38
Molecular Structure Molecular Structure of 94-44-0 (Benzyl nicotinate) Hazard Symbols IrritantXi
Synonyms

Nicotinicacid, benzyl ester (6CI,7CI,8CI);Benzylpyridine-3-carboxylate;Niacin benzyl ester;Pyridine-3-carboxylic acid benzylester;Rubriment;

Article Data 35

Benzyl nicotinate Chemical Properties

MF: C13H11NO2
MW: 213.23
EINECS: 202-332-3
Density: 1.1165 g/cm3
Flash point: 170°C
Refractive index  n20/D 1.570
Enthalpy of Vaporization: 57.7 kJ/mol 
Boiling Point: 334.1 °C at 760 mmHg 
Vapour Pressure: 0.000131 mmHg at 25°C 
IUPAC Name: benzyl pyridine-3-carboxylate
Melting Point of Niacin benzyl ester (94-44-0): 24 °C(lit.)
Synonyms: 3-Pyridinecarboxylic acid, phenylmethyl ester ; 3-Pyridinecarboxylicacid,phenylmethylester ; Benzyl pyridine-3-carboxylate ; Benzylpyridine-3-carboxylate ; Estru benzylowego kwasu nikotynowego ; Estrubenzylowegokwasunikotynowego ; Niacin benzyl ester ; Niacinbenzylester
Following is the molecular structure of Niacin benzyl ester (94-44-0):

Benzyl nicotinate Toxicity Data With Reference

1.    

orl-rat LD50:2188 mg/kg

    BCTKAG    Bromatologia i Chemia Toksykologiczna. 12 (1979),79.
2.    

ivn-mus LD50:100 mg/kg

    PHARAT    Pharmazie. 11 (1956),242.

Benzyl nicotinate Consensus Reports

Reported in EPA TSCA Inventory.

Benzyl nicotinate Safety Profile

Poison by intravenous route. Moderately toxic by ingestion. When heated to decomposition it emits toxic vapors of NOx.
Safety Information of Niacin benzyl ester (94-44-0): 24 °C(lit.)
Hazard Codes: Xi
Xi: Irritant
Risk Statements: 36/38
36/38: Irritating to eyes and skin 
Safety Statements: 26
26:  In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
WGK Germany: 2
RTECS: QT0850000
F8:Photosensitive.

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