- InChI
- InChI=1S/C17H34/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17(2)3/h2,4-16H2,1,3H3
- InChI Key
- DRLMBCPWFSTWNY-UHFFFAOYSA-N
- Formula
- C17H34
- SMILES
- C=C(C)CCCCCCCCCCCCCC
- Molecular Weight1
- 238.45
- CAS
- 61868-19-7
- Other Names
-
- 1-Hexadecene, 2-methyl
- 2-Methyl-1-hexadecene
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.7166 | Relay (1.0) Calculated Property | |
| ΔfG° | 171.55 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -301.35 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 37.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.27 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.47 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.654 | Crippen Calculated Property | |
| McVol | 246.090 | ml/mol | McGowan Calculated Property |
| Pc | 1272.78 | kPa | Joback Calculated Property |
| Inp | [1685.00; 1689.00] |
|
|
| Inp | 1689.00 | NIST | |
| Inp | 1685.00 | NIST | |
| Inp | 1685.00 | NIST | |
| Inp | 1689.00 | NIST | |
| Tboil | 562.44 | K | Relay (1.0) Calculated Property |
| Tc | 724.42 | K | Relay (1.0) Calculated Property |
| Tfus | 279.36 | K | Relay (1.0) Calculated Property |
| Vc | 0.973 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [356.46; 867.59] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.52470e+01 | |||
| Coefficient B | 1.59874e+00 | |||
| Coefficient C | -9.26200e-04 | |||
| Coefficient D | 2.10300e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 356.46 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 443.74 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 521.85 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 591.45 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 653.20 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 707.78 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 755.84 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 798.05 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 835.08 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 867.59 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [429.30; 596.48] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.54737e+01 | |||
| Coefficient B | -5.13527e+03 | |||
| Coefficient C | -9.11500e+01 | |||
| Temperature range, min. | 429.30 | |||
| Temperature range, max. | 596.48 | |||
| Pvap | 1.33 | kPa | 429.30 | Calculated Property |
| Pvap | 2.94 | kPa | 447.88 | Calculated Property |
| Pvap | 5.99 | kPa | 466.45 | Calculated Property |
| Pvap | 11.43 | kPa | 485.03 | Calculated Property |
| Pvap | 20.56 | kPa | 503.60 | Calculated Property |
| Pvap | 35.15 | kPa | 522.18 | Calculated Property |
| Pvap | 57.51 | kPa | 540.75 | Calculated Property |
| Pvap | 90.48 | kPa | 559.33 | Calculated Property |
| Pvap | 137.51 | kPa | 577.90 | Calculated Property |
| Pvap | 202.66 | kPa | 596.48 | Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methylhexadec-1-ene.
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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