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590-17-0

590-17-0 structural image
Product Name: Bromoacetonitrile
Formula: C2H2BrN
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Bromoacetonitrile is a pale yellow to light amber liquid. (NTP, 1992)
Color/Form Pale yellow to light amber liquid
Boiling Point 302 to 304 °F at 752 mmHg (NTP, 1992)
Flash Point greater than 200 °F (NTP, 1992)
Solubility 50 to 100 mg/mL at 70.7 °F (NTP, 1992)
Density 1.722 (NTP, 1992) - Denser than water; will sink
Vapor Pressure VP: 24 mm Hg at 60-62 °C
Decomposition When heated to decomposition it emits toxic vapors of /oxides of nitrogen and bromines/.
Refractive Index Index of refraction = 1.4800 at 20 °C
Kovats Retention Index 725 725
Other Experimental Properties May be sensitive to prolonged exposure to air and light; is incompatible with strong acids, strong bases, strong oxidizing agents and strong reducing agents
Chemical Classes Nitrogen Compounds -> Nitriles

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 119.95 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 118.93706 g/mol
Monoisotopic Mass 118.93706 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 4
Formal Charge 0
Complexity 41.2
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

Bromoacetonitrile is a pale yellow to light amber liquid. (NTP, 1992)

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