- InChI
- InChI=1S/C8H16/c1-4-6-8(3)7-5-2/h4,6,8H,5,7H2,1-3H3
- InChI Key
- SVGLFIBXFVQUQY-UHFFFAOYSA-N
- Formula
- C8H16
- SMILES
- CC=CC(C)CCC
- Molecular Weight1
- 112.21
- CAS
- 3404-56-6
- Other Names
-
- 2-heptene, 4-methyl-
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 | 0.2977 | Relay (1.0) Calculated Property | |
| ΔfG° | 94.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -121.08 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 13.15 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.46 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.92 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.13 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.999 | Crippen Calculated Property | |
| McVol | 119.280 | ml/mol | McGowan Calculated Property |
| Pc | 2695.80 | kPa | Joback Calculated Property |
| Inp | [746.20; 746.20] |
|
|
| Inp | 746.20 | NIST | |
| Inp | 746.20 | NIST | |
| Tboil | [386.65; 387.10] | K |
|
| Tboil | 386.65 ± 0.50 | K | NIST |
| Tboil | 387.10 ± 0.60 | K | NIST |
| Tc | 548.12 | K | Relay (1.0) Calculated Property |
| Tfus | 159.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.440 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [218.03; 289.53] | J/mol×K | [386.36; 562.34] |
|
| Cp,gas | 218.03 | J/mol×K | 386.36 | Joback Calculated Property |
| Cp,gas | 231.33 | J/mol×K | 415.69 | Joback Calculated Property |
| Cp,gas | 244.04 | J/mol×K | 445.02 | Joback Calculated Property |
| Cp,gas | 256.20 | J/mol×K | 474.35 | Joback Calculated Property |
| Cp,gas | 267.82 | J/mol×K | 503.68 | Joback Calculated Property |
| Cp,gas | 278.93 | J/mol×K | 533.01 | Joback Calculated Property |
| Cp,gas | 289.53 | J/mol×K | 562.34 | Joback Calculated Property |
| η | [0.0001947; 0.0101457] | Pa×s | [159.84; 386.36] |
|
| η | 0.0101457 | Pa×s | 159.84 | Joback Calculated Property |
| η | 0.0027975 | Pa×s | 197.59 | Joback Calculated Property |
| η | 0.0011662 | Pa×s | 235.35 | Joback Calculated Property |
| η | 0.0006192 | Pa×s | 273.10 | Joback Calculated Property |
| η | 0.0003834 | Pa×s | 310.85 | Joback Calculated Property |
| η | 0.0002634 | Pa×s | 348.61 | Joback Calculated Property |
| η | 0.0001947 | Pa×s | 386.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Methyl-2-heptene.
Sources
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