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19624-22-7

19624-22-7 structural image
Product Name: Pentaborane
Formula: B5H9
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Pentaborane appears as a clear colorless liquid with a pungent odor like sour milk. Freezing point -52.9 °F (-46.6 °C). Boiling point 136.4 °F (58 °C). Decomposition temperature 302 °F (150 °C). Vapors toxic both under prolonged exposure to low concentrations and short exposure to high concentrations. Density 0.61 g / cm3. Under prolonged exposure to intense heat the containers may rupture violently and rocket.
Color/Form Colorless liquid.
Odor Strong, pungent, foul
Boiling Point 140 °F at 760 mmHg (EPA, 1998)
Melting Point -51.9 °F (EPA, 1998)
Flash Point 86 °F (EPA, 1998)
Solubility Reacts with water (NIOSH, 2023)
Density 0.61 at 32 °F (EPA, 1998) - Less dense than water; will float
Vapor Density 2.2
Vapor Pressure 171 mmHg at 68 °F (EPA, 1998)
Stability/Shelf Life Conditions contributing to instability: Temperatures above 150 °C (302 F) cause decomposition and pressure buildup in containers.
Autoignition Temperature Spontaneously flammable if impure. Approx. 35 °C when pure. (USCG, 1999)
Decomposition Decomposes above 300 °F (149 °C) if it is not already ignited.
Viscosity 0.319 centipoise at 70 °F
Corrosivity Corrosive to natural rubber, some synthetic rubber, some greases, and some lubricants
Heat of Combustion -29,100 BTU/lb = -16,200 cal/g = -677X10+5 J/kg
Heat of Vaporization 219 BTU/lb = 122 cal/g = 5.10X10+5 J/kg
Surface Tension 20.8 dynes/cm = 0.0208 N/m at 25 °C
Ionization Potential 9.90 eV
Odor Threshold Odor Threshold Low: 0.97 [mmHg] Odor threshold from AIHA
Other Experimental Properties Standard enthalpy of formation: 42.7 kJ/mol (liquid); 73.2 kJ/mol (gas); molar heat capacity at 25 °C: 151.1 J/mol K (liquid); 99.6 J/mol K (gas)
Chemical Classes Toxic Gases & Vapors -> Hydrides

COMPUTED DESCRIPTORS

Molecular Weight 323.31 g/mol
XLogP3 4.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 323.03811610 g/mol
Monoisotopic Mass 323.03811610 g/mol
Topological Polar Surface Area 96.4 Ų
Heavy Atom Count 21
Formal Charge 0
Complexity 387
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

Pentaborane appears as a clear colorless liquid with a pungent odor like sour milk. Freezing point -52.9 °F (-46.6 °C). Boiling point 136.4 °F (58 °C). Decomposition temperature 302 °F (150 °C). Vapors toxic both under prolonged exposure to low concentrations and short exposure to high concentrations. Density 0.61 g / cm3. Under prolonged exposure to intense heat the containers may rupture violently and rocket.