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624-91-9

624-91-9 structural image
Product Name: Nitrous acid methyl ester
Formula: CH3NO2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Methyl nitrite appears as a liquid or gas Boils at 10.4 °F. Moderately toxic by inhalation. Narcotic in high concentrations. Used as a rocket propellant. Differs from nitromethane (H3CNO2).
Color/Form Gas
Boiling Point 64.6 °C @ 760 mm Hg (explodes)
Melting Point -16 °C
Solubility Soluble in ethanol and ether
Density 0.991
Vapor Pressure 1,650 mm Hg @ 25 °C /Estimated/
LogP log Kow = 0.88 /Estimated/
Henry's Law Constant Henry's Law constant = 6.6X10-5 atm-cu m/mole /Estimated/
Kovats Retention Index 268
Other Experimental Properties Hydroxyl radical reaction rate constant = 2.2X10-13 cu cm/molecule-sec
Chemical Classes Nitrogen Compounds -> Nitrates and Nitrites

COMPUTED DESCRIPTORS

Molecular Weight 61.040 g/mol
XLogP3 0
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 0
Exact Mass 61.016378338 g/mol
Monoisotopic Mass 61.016378338 g/mol
Topological Polar Surface Area 38.7 Ų
Heavy Atom Count 4
Formal Charge 0
Complexity 20
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 nitrite appears as a liquid or gas Boils at 10.4 °F. Moderately toxic by inhalation. Narcotic in high concentrations. Used as a rocket propellant. Differs from nitromethane (H3CNO2).