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93-60-7

93-60-7 structural image
Product Name: Methyl nicotinate
Formula: C7H7NO2
Synonyms: Methyl nicotinate;Nicotinic acid methyl ester
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid; [Merck Index]
Boiling Point 209
Melting Point 38-43
Solubility Soluble
Vapor Pressure 0.27 [mmHg]
LogP 0.8
Kovats Retention Index 1100 1116 1098 1100 1127.1
Chemical Classes Nitrogen Compounds -> Pyridines

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P271:Use only outdoors or in a well-ventilated area.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 137.14 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 137.047678466 g/mol
Monoisotopic Mass 137.047678466 g/mol
Topological Polar Surface Area 39.2 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 125
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Methyl nicotinate is a member of pyridines and an aromatic carboxylic acid.

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