- InChI
- InChI=1S/C30H60/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h23,25H,3-22,24,26-30H2,1-2H3/b25-23+
- InChI Key
- UXBBYDBWOJZQJD-WJTDDFOZSA-N
- Formula
- C30H60
- SMILES
-
CCCCCCCCCCCC=CCCCCCCCCCCCCCCCC
C - Molecular Weight1
- 420.80
- 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 | 1.1409 | Relay (1.0) Calculated Property | |
| ΔfG° | 281.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -595.06 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 73.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 149.34 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.40 | eV | Relay (1.0) Calculated Property |
| log10WS | -10.97 | Relay (1.0) Calculated Property | |
| logPoct/wat | 11.725 | Crippen Calculated Property | |
| McVol | 429.260 | ml/mol | McGowan Calculated Property |
| Pc | 610.87 | kPa | Joback Calculated Property |
| Inp | [3278.00; 3278.00] |
|
|
| Inp | 3278.00 | NIST | |
| Inp | 3278.00 | NIST | |
| Tboil | 642.18 | K | Relay (1.0) Calculated Property |
| Tc | 818.28 | K | Relay (1.0) Calculated Property |
| Tfus | 302.57 | K | Relay (1.0) Calculated Property |
| Vc | 1.700 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [627.89; 1536.48] | 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 | -3.85640e+01 | |||
| Coefficient B | 2.87384e+00 | |||
| Coefficient C | -1.69200e-03 | |||
| Coefficient D | 3.93200e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 627.89 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 783.78 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 923.03 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 1046.89 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 1156.60 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1253.41 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1338.56 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1413.29 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1478.85 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1536.48 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0010116; 0.0000373] | Pa×s | [422.78; 766.58] |
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 | -1.42558e+01 | |||
| Coefficient B | 3.11148e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 422.78 | |||
| Temperature range, max. | 766.58 | |||
| η | 0.0010116 | Pa×s | 422.78 | Calculated Property |
| η | 0.0005497 | Pa×s | 460.98 | Calculated Property |
| η | 0.0003280 | Pa×s | 499.18 | Calculated Property |
| η | 0.0002106 | Pa×s | 537.38 | Calculated Property |
| η | 0.0001434 | Pa×s | 575.58 | Calculated Property |
| η | 0.0001024 | Pa×s | 613.78 | Calculated Property |
| η | 0.0000761 | Pa×s | 651.98 | Calculated Property |
| η | 0.0000584 | Pa×s | 690.18 | Calculated Property |
| η | 0.0000461 | Pa×s | 728.38 | Calculated Property |
| η | 0.0000373 | Pa×s | 766.58 | Calculated Property |
Similar Compounds
Find more compounds similar to 12-Tritriacontene.
Sources
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