- InChI
- InChI=1S/C15H30/c1-12(2)15-10-8-13(3)6-5-7-14(4)9-11-15/h12-15H,5-11H2,1-4H3
- InChI Key
- IBMAYSYTZAVZPY-UHFFFAOYSA-N
- Formula
- C15H30
- SMILES
- CC1CCCC(C)CCC(C(C)C)CC1
- Molecular Weight1
- 210.41
- 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.
- Ip : 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 | 0.3223 | Relay (1.0) Calculated Property | |
| ΔfG° | 33.61 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -348.50 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 16.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.65 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.10 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.44 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.275 | Crippen Calculated Property | |
| McVol | 211.350 | ml/mol | McGowan Calculated Property |
| Pc | 1720.31 | kPa | Joback Calculated Property |
| Inp | [1479.00; 1482.00] |
|
|
| Inp | 1479.00 | NIST | |
| Inp | 1480.00 | NIST | |
| Inp | 1482.00 | NIST | |
| Ip | 1585.00 | NIST | |
| Tboil | 549.31 | K | Relay (1.0) Calculated Property |
| Tc | 727.04 | K | Relay (1.0) Calculated Property |
| Tfus | 247.23 | K | Relay (1.0) Calculated Property |
| Vc | 0.725 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [270.22; 799.24] | 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 | -8.66400e+01 | |||
| Coefficient B | 1.46548e+00 | |||
| Coefficient C | -5.80000e-04 | |||
| Coefficient D | 4.00000e-10 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 270.22 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 359.24 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 440.70 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 514.60 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 580.93 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 639.71 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 690.93 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 734.59 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 770.69 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 799.24 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0283190; 0.0000917] | Pa×s | [228.63; 550.05] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.33750e+01 | |||
| Coefficient B | 2.24303e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 228.63 | |||
| Temperature range, max. | 550.05 | |||
| η | 0.0283190 | Pa×s | 228.63 | Calculated Property |
| η | 0.0075237 | Pa×s | 264.34 | Calculated Property |
| η | 0.0027404 | Pa×s | 300.06 | Calculated Property |
| η | 0.0012374 | Pa×s | 335.77 | Calculated Property |
| η | 0.0006510 | Pa×s | 371.49 | Calculated Property |
| η | 0.0003834 | Pa×s | 407.20 | Calculated Property |
| η | 0.0002459 | Pa×s | 442.91 | Calculated Property |
| η | 0.0001685 | Pa×s | 478.63 | Calculated Property |
| η | 0.0001217 | Pa×s | 514.34 | Calculated Property |
| η | 0.0000917 | Pa×s | 550.05 | Calculated Property |
Similar Compounds
Find more compounds similar to Germacrane-c.
Sources
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