- InChI
- InChI=1S/C35H69N/c1-3-4-5-6-7-20-23-26-29-32-35(2)33-30-27-24-21-18-16-14-12-10-8-9-11-13-15-17-19-22-25-28-31-34-36/h35H,3-33H2,1-2H3
- InChI Key
- UYEHKWKWOSPIIC-UHFFFAOYSA-N
- Formula
- C35H69N
- SMILES
-
CCCCCCCCCCCC(C)CCCCCCCCCCCCCCC
CCCCCCC#N - Molecular Weight1
- 503.94
- 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).
- 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 | 1.4337 | Relay (1.0) Calculated Property | |
| ΔfG° | 374.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -644.88 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 84.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 175.48 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.94 | eV | Relay (1.0) Calculated Property |
| log10WS | -12.22 | Relay (1.0) Calculated Property | |
| logPoct/wat | 13.259 | Crippen Calculated Property | |
| McVol | 505.390 | ml/mol | McGowan Calculated Property |
| Pc | 473.62 | kPa | Joback Calculated Property |
| Inp | [3785.00; 3785.00] |
|
|
| Inp | 3785.00 | NIST | |
| Inp | 3785.00 | NIST | |
| Tboil | 708.53 | K | Relay (1.0) Calculated Property |
| Tc | 915.62 | K | Relay (1.0) Calculated Property |
| Tfus | 328.92 | K | Relay (1.0) Calculated Property |
| Vc | 1.947 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1873.06; 2033.59] | J/mol×K | [1101.84; 1416.68] |
|
| Cp,gas | 1873.06 | J/mol×K | 1101.84 | Joback Calculated Property |
| Cp,gas | 1905.17 | J/mol×K | 1154.31 | Joback Calculated Property |
| Cp,gas | 1934.67 | J/mol×K | 1206.79 | Joback Calculated Property |
| Cp,gas | 1961.92 | J/mol×K | 1259.26 | Joback Calculated Property |
| Cp,gas | 1987.26 | J/mol×K | 1311.74 | Joback Calculated Property |
| Cp,gas | 2011.03 | J/mol×K | 1364.21 | Joback Calculated Property |
| Cp,gas | 2033.59 | J/mol×K | 1416.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 22-Methyl-tritriacontyl cyanide.
Sources
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