- InChI
- InChI=1S/C31H48/c1-3-5-7-9-11-13-15-17-22-28(23-18-16-14-12-10-8-6-4-2)31-27-21-25-29-24-19-20-26-30(29)31/h19-22,24-27H,3-18,23H2,1-2H3/b28-22+
- InChI Key
- PARGRVDINWXKDV-XAYXJRQQSA-N
- Formula
- C31H48
- SMILES
-
CCCCCCCCCC=C(CCCCCCCCCC)c1cccc
2ccccc12 - Molecular Weight1
- 420.71
- CAS
- 55319-81-8
- Other Names
-
- 1-(1-Decylundec-1-enyl)naphthalene
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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).
- 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 | 1.0855 | Relay (1.0) Calculated Property | |
| ΔfG° | 491.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -204.66 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 65.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 135.57 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.00 | eV | Relay (1.0) Calculated Property |
| log10WS | -10.15 | Relay (1.0) Calculated Property | |
| logPoct/wat | 10.895 | Crippen Calculated Property | |
| McVol | 400.130 | ml/mol | McGowan Calculated Property |
| Pc | 782.00 | kPa | Joback Calculated Property |
| Tboil | 717.09 | K | Relay (1.0) Calculated Property |
| Tc | 929.73 | K | Relay (1.0) Calculated Property |
| Tfus | 296.25 | K | Relay (1.0) Calculated Property |
| Vc | 1.504 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1353.17; 1472.41] | J/mol×K | [963.36; 1179.52] | 
|
| Cp,gas | 1353.17 | J/mol×K | 963.36 | Joback Calculated Property |
| Cp,gas | 1375.08 | J/mol×K | 999.39 | Joback Calculated Property |
| Cp,gas | 1396.00 | J/mol×K | 1035.41 | Joback Calculated Property |
| Cp,gas | 1416.05 | J/mol×K | 1071.44 | Joback Calculated Property |
| Cp,gas | 1435.38 | J/mol×K | 1107.47 | Joback Calculated Property |
| Cp,gas | 1454.12 | J/mol×K | 1143.49 | Joback Calculated Property |
| Cp,gas | 1472.41 | J/mol×K | 1179.52 | Joback Calculated Property |
| ΔvapH | 105.10 | kJ/mol | 533.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [566.71; 784.44] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 2.00637e+01 | |||
| Coefficient B | -1.26436e+04 | |||
| Coefficient C | 7.26270e+01 | |||
| Temperature range, min. | 566.71 | |||
| Temperature range, max. | 784.44 | |||
| Pvap | 1.33 | kPa | 566.71 | Calculated Property |
| Pvap | 2.74 | kPa | 590.90 | Calculated Property |
| Pvap | 5.36 | kPa | 615.09 | Calculated Property |
| Pvap | 10.01 | kPa | 639.29 | Calculated Property |
| Pvap | 17.95 | kPa | 663.48 | Calculated Property |
| Pvap | 31.00 | kPa | 687.67 | Calculated Property |
| Pvap | 51.76 | kPa | 711.86 | Calculated Property |
| Pvap | 83.84 | kPa | 736.06 | Calculated Property |
| Pvap | 132.03 | kPa | 760.25 | Calculated Property |
| Pvap | 202.65 | kPa | 784.44 | Calculated Property |
Similar Compounds
Find more compounds similar to Naphthalene, 1-(1-decyl-1-undecenyl)-.
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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