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620-22-4

620-22-4 structural image
Product Name: m-Tolunitrile
Formula: C8H7N
Synonyms: 3-Methylbenzonitrile
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description M-tolunitrile is a clear, yellow liquid. (NTP, 1992)
Boiling Point 415 °F at 760 mmHg (NTP, 1992)
Melting Point -9 °F (NTP, 1992)
Flash Point 188 °F (NTP, 1992)
Solubility less than 1 mg/mL at 77 °F (NTP, 1992)
Density 1.0316 at 68 °F (NTP, 1992) - Denser than water; will sink
Vapor Pressure 0.18 [mmHg]
Kovats Retention Index 1094.3 178.8
Chemical Classes Nitrogen Compounds -> Nitriles

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H303:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
Precautionary Statement Codes 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 117.15 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 117.057849228 g/mol
Monoisotopic Mass 117.057849228 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 131
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

M-tolunitrile is a clear, yellow liquid. (NTP, 1992)

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