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Chemical Tweak

  • Industrial Safety
  • Chemical Engineering
  • Calculators & Tools

Boiling Point Calculator: Using Antoine Equation

In industrial operations, pressure varies continuously with pressure, which makes standard boiling point values insufficient for practical use.Whether you are working with vacuum distillation, high-pressure systems, or process design calculations, you need a reliable way to determine the actual phase-change temperature under operating conditions.

Our Boiling Point Calculator is built to solve this exact problem. It uses the Antoine Equation, a widely accepted thermodynamic model, to calculate boiling point with high accuracy across different pressures. The calculation is based on three substance-specific constants (A, B, and C), ensuring results that are suitable for both academic analysis and real plant applications.

What is the Boiling Point?

The boiling point of a substance is the temperature at which its vapor pressure equals the surrounding atmospheric pressure. At this point, the liquid transitions into a gas. Because atmospheric pressure varies with altitude and process conditions, a reliable calculator is necessary to determine the specific temperature required for phase change at any given pressure.

Boiling Point Calculator Antoine equation

What is the Antoine Equation?

The equation is an empirical mathematical expression that describes the relationship between vapor pressure and temperature for pure substances.

The standard formula is:

    \[\log_{10}P = A - \frac{B}{T + C}\]

Where:

  • P: Vapor Pressure (mmHg).
  • T: Temperature (°C).
  • A, B, C: Substance-specific coefficients

If you do not have the Antoine constants but know the heat of vaporisation, you can use our Vapor Pressure Calculator (Clausius-Clapeyron) for your estimations as boiling points can also be estimated using the Clausius-Clapeyron Equation.

Antoine Equation vs. Clausius-Clapeyron Equation

FeatureAntoine EquationClausius-Clapeyron
AccuracyHigh (uses 3 specific constants)Moderate (theoretical approximation)
Data NeededConstants A, B, and CEnthalpy of Vaporization (\Delta H_{vap})
Best ForSpecific industrial chemicals and solventsGeneral thermodynamic calculations and unknown substances

Technical Reference: Antoine Constants Table

The constants (A, B, C) used in this calculator are curated from the following high-authority thermodynamic databases NIST Chemistry WebBook

Chemical NameFormulaConstant AConstant BConstant CRange (°C)
AcetoneC3​H6​O7.024471161224-32 to 77
Methyl Ethyl KetoneC4​H8​O7.063561261.34221.97-6 to 80
ChloroformCHCl3​6.903281163.03227.410 to 60
DichloromethaneCH2​Cl2​7.08031138.91231.45-40 to 40
Carbon TetrachlorideCCl4​6.93391242.43227.26-20 to 100
Ethyl AcetateC4​H8​O2​7.101791244.95217.8815 to 77
Diethyl EtherC4​H10​O6.923741064.07228.8-61 to 20
TetrahydrofuranC4​H8​O6.995151202.29226.254-15 to 67
Dimethyl SulfoxideC2​H6​OS7.40381736206.220 to 189
MethanolCH4​O8.080971582.271239.72615 to 100
EthanolC2​H6​O8.204171642.89230.3-57 to 80
n-PropanolC3​H8​O7.847671499.21204.6420 to 120
IsopropanolC3​H8​O8.117781580.92219.610 to 82
n-ButanolC4​H10​O7.47681362.39178.7730 to 118
n-PentanolC5​H12​O7.182461287.625161.3350 to 138
Ethylene GlycolC2​H6​O2​8.090832088.936203.5450 to 200
BenzeneC6​H6​6.905651211.033220.797 to 80
TolueneC7​H8​6.954641344.8219.4813 to 110
EthylbenzeneC8​H10​6.957191424.25213.225 to 136
n-PentaneC5​H12​6.852211064.63232-50 to 58
n-HexaneC6​H14​6.877761171.53224.366-25 to 92
n-HeptaneC7​H16​6.90241268.11216.9-2 to 124
n-OctaneC8​H18​6.918681355.12209.5119 to 152
n-NonaneC9​H20​6.938931431.82202.6938 to 178
n-DecaneC10​H22​6.953671495.17193.8658 to 203
CyclohexaneC6​H12​6.844981203.53222.8610 to 81
IsobutaneC4​H10​6.74048882.8240-86 to -12
n-ButaneC4​H10​6.82485943.453239.711-73 to 19
Acetic AcidCH3​COOH7.188071416.721117 to 118
Sulfuric AcidH2​SO4​7.072282018.75109.5150 to 330
Nitric AcidHNO3​7.421295.4215.30 to 83
Formic AcidCH2​O2​7.37791563.28247.0736 to 108
Propionic AcidC3​H6​O2​7.714231733.16231.5820 to 141
AmmoniaNH3​7.554661002.71247.88-83 to 60
NitrogenN2​6.49521255.719266.55-210 to -190
OxygenO2​6.69147319.01266.69-210 to -173
HydrogenH2​4.62244.27269.1-259 to -248
PropaneC3​H8​6.80398803.99246.99-108 to -25
Carbon DioxideCO2​6.812281301.679273.33-78 to 31
WaterH2​O8.071311730.63233.4261 to 100

FAQ

1. Why use the Antoine Equation instead of Clausius-Clapeyron for boiling point calculation?

While the Clausius-Clapeyron equation
is a good theoretical approximation, the Antoine Equation is significantly more accurate for industrial applications. It uses a three-parameter model (A, B, C) that accounts for the curvature of the vapor pressure line more effectively than the simpler two-parameter Clausius-Clapeyron model.

2. Does the boiling point change with altitude?

Yes. Boiling occurs when a liquid’s vapor pressure equals the surrounding atmospheric pressure. Since atmospheric pressure is lower at higher altitudes, the boiling point decreases.

3. How to find the boiling point for a vacuum system?

To find the boiling point under vacuum, enter your target vacuum pressure (e.g., in mmHg or bar) into our Boiling Point Calculator.

4. Is there a limit to the accuracy of these calculations?

Antoine constants are valid only within a specific temperature range (Tmin–Tmax). Using them outside this range can cause large errors. The tool shows a boundary warning when your result is near these limits.

Ronak Prajapati

Chemical engineer (B.Tech chemical & Post Diploma in Industrial Safety) with 7+ years of experience in operations/production & commissioning. Currently working on a greenfield polysilicon project. I publish hands-on process engineering guides at ChemicalTweak.com. Connect with me on LinkedIn.

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