- InChI
- InChI=1S/C18H37Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19/h2-18H2,1H3
- InChI Key
- VUQPJRPDRDVQMN-UHFFFAOYSA-N
- Formula
- C18H37Cl
- SMILES
- CCCCCCCCCCCCCCCCCCCl
- Molecular Weight1
- 288.94
- CAS
- 3386-33-2
- Other Names
-
- 1-Chlorooctadecane
- Chlorooctadecane
- N-OCTADECYL CHLORIDE
- Octadecyl chloride
- 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).
- 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).
- Inp : Non-polar retention indices.
- I : 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 |
|---|---|---|---|
| ΔfG° | 88.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -430.59 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 46.57 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.05 | kJ/mol | Joback Calculated Property |
| log10WS | -7.51 | Crippen Calculated Property | |
| logPoct/wat | 7.487 | Crippen Calculated Property | |
| McVol | 276.720 | ml/mol | McGowan Calculated Property |
| Pc | 1123.81 | kPa | Joback Calculated Property |
| Inp | [346.70; 2079.00] |
|
|
| Inp | 2079.00 | NIST | |
| Inp | 346.70 | NIST | |
| Inp | 2070.00 | NIST | |
| Inp | 2069.80 | NIST | |
| I | [2288.00; 2312.00] |
|
|
| I | 2288.00 | NIST | |
| I | 2312.00 | NIST | |
| I | 2294.00 | NIST | |
| Tboil | 292.65 | K | KDB |
| Tc | 812.72 | K | Joback Calculated Property |
| Tfus | 292.65 | K | KDB |
| Vc | 1.093 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [762.81; 867.07] | J/mol×K | [648.67; 812.72] |
|
| Cp,gas | 762.81 | J/mol×K | 648.67 | Joback Calculated Property |
| Cp,gas | 782.14 | J/mol×K | 676.01 | Joback Calculated Property |
| Cp,gas | 800.65 | J/mol×K | 703.35 | Joback Calculated Property |
| Cp,gas | 818.38 | J/mol×K | 730.70 | Joback Calculated Property |
| Cp,gas | 835.34 | J/mol×K | 758.04 | Joback Calculated Property |
| Cp,gas | 851.56 | J/mol×K | 785.38 | Joback Calculated Property |
| Cp,gas | 867.07 | J/mol×K | 812.72 | Joback Calculated Property |
| η | [0.0001121; 0.0033349] | Pa×s | [322.54; 648.67] |
|
| η | 0.0033349 | Pa×s | 322.54 | Joback Calculated Property |
| η | 0.0012601 | Pa×s | 376.89 | Joback Calculated Property |
| η | 0.0006085 | Pa×s | 431.25 | Joback Calculated Property |
| η | 0.0003459 | Pa×s | 485.61 | Joback Calculated Property |
| η | 0.0002203 | Pa×s | 539.96 | Joback Calculated Property |
| η | 0.0001524 | Pa×s | 594.32 | Joback Calculated Property |
| η | 0.0001121 | Pa×s | 648.67 | Joback Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [481.12; 692.17] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.40282e+01 | |||
| Coefficient B | -5.03151e+03 | |||
| Coefficient C | -1.14942e+02 | |||
| Temperature range, min. | 481.12 | |||
| Temperature range, max. | 692.17 | |||
| Pvap | 1.33 | kPa | 481.12 | Calculated Property |
| Pvap | 3.05 | kPa | 504.57 | Calculated Property |
| Pvap | 6.35 | kPa | 528.02 | Calculated Property |
| Pvap | 12.21 | kPa | 551.47 | Calculated Property |
| Pvap | 21.97 | kPa | 574.92 | Calculated Property |
| Pvap | 37.35 | kPa | 598.37 | Calculated Property |
| Pvap | 60.44 | kPa | 621.82 | Calculated Property |
| Pvap | 93.75 | kPa | 645.27 | Calculated Property |
| Pvap | 140.11 | kPa | 668.72 | Calculated Property |
| Pvap | 202.66 | kPa | 692.17 | Calculated Property |
| Pvap | [1.35; 271.55] | kPa | [472.15; 673.15] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 1.24085e+02 | |||
| Coefficient B | -1.52071e+04 | |||
| Coefficient C | -1.50336e+01 | |||
| Coefficient D | 4.43161e-06 | |||
| Temperature range, min. | 472.15 | |||
| Temperature range, max. | 673.15 | |||
| Pvap | 1.35 | kPa | 472.15 | Calculated Property |
| Pvap | 3.17 | kPa | 494.48 | Calculated Property |
| Pvap | 6.82 | kPa | 516.82 | Calculated Property |
| Pvap | 13.55 | kPa | 539.15 | Calculated Property |
| Pvap | 25.21 | kPa | 561.48 | Calculated Property |
| Pvap | 44.27 | kPa | 583.82 | Calculated Property |
| Pvap | 73.95 | kPa | 606.15 | Calculated Property |
| Pvap | 118.29 | kPa | 628.48 | Calculated Property |
| Pvap | 182.20 | kPa | 650.82 | Calculated Property |
| Pvap | 271.55 | kPa | 673.15 | Calculated Property |
Similar Compounds
Find more compounds similar to Octadecane, 1-chloro-.
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Crippen Method
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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