- InChI
- InChI=1S/C37H77N/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38(3)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h4-37H2,1-3H3
- InChI Key
- VFLWKHBYVIUAMP-UHFFFAOYSA-N
- Formula
- C37H77N
- SMILES
-
CCCCCCCCCCCCCCCCCCN(C)CCCCCCCC
CCCCCCCCCC - Molecular Weight1
- 536.03
- CAS
- 4088-22-6
- Other Names
-
- N-methyldioctadecylamine
- 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).
- Pvap : Vapor 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 | 1.4604 | Relay (1.0) Calculated Property | |
| ΔfG° | 371.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -756.65 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 94.61 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 176.88 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.79 | eV | Relay (1.0) Calculated Property |
| log10WS | -11.53 | Relay (1.0) Calculated Property | |
| logPoct/wat | 13.441 | Crippen Calculated Property | |
| McVol | 542.170 | ml/mol | McGowan Calculated Property |
| Pc | 439.14 | kPa | Joback Calculated Property |
| Inp | [3700.00; 3700.00] |
|
|
| Inp | 3700.00 | NIST | |
| Inp | 3700.00 | NIST | |
| Tboil | 695.57 | K | Relay (1.0) Calculated Property |
| Tc | 857.59 | K | Relay (1.0) Calculated Property |
| Tfus | 313.15 ± 2.00 | K | NIST |
| Vc | 2.134 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [805.90; 1966.22] | 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 | -4.14360e+01 | |||
| Coefficient B | 3.64276e+00 | |||
| Coefficient C | -2.10160e-03 | |||
| Coefficient D | 4.66500e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 805.90 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 1004.91 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 1182.96 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 1341.52 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 1482.07 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 1606.08 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 1715.02 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 1810.38 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 1893.62 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 1966.22 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.65] | kPa | [606.76; 829.46] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.54294e+01 | |||
| Coefficient B | -6.79116e+03 | |||
| Coefficient C | -1.58254e+02 | |||
| Temperature range, min. | 606.76 | |||
| Temperature range, max. | 829.46 | |||
| Pvap | 1.33 | kPa | 606.76 | Calculated Property |
| Pvap | 2.94 | kPa | 631.50 | Calculated Property |
| Pvap | 6.00 | kPa | 656.25 | Calculated Property |
| Pvap | 11.45 | kPa | 680.99 | Calculated Property |
| Pvap | 20.59 | kPa | 705.74 | Calculated Property |
| Pvap | 35.21 | kPa | 730.48 | Calculated Property |
| Pvap | 57.59 | kPa | 755.23 | Calculated Property |
| Pvap | 90.57 | kPa | 779.97 | Calculated Property |
| Pvap | 137.58 | kPa | 804.72 | Calculated Property |
| Pvap | 202.65 | kPa | 829.46 | Calculated Property |
Similar Compounds
Find more compounds similar to Distearyl methyl amine.
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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