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.