- InChI
- InChI=1S/C12H25N/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h12H,1-11,13H2
- InChI Key
- HBGGBCVEFUPUNY-UHFFFAOYSA-N
- Formula
- C12H25N
- SMILES
- NC1CCCCCCCCCCC1
- Molecular Weight1
- 183.33
- CAS
- 1502-03-0
- Other Names
-
- Cyclododecanamine
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -255.01 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 11.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 66.31 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.50 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 3.618 | Crippen Calculated Property | |
| McVol | 179.060 | ml/mol | McGowan Calculated Property |
| Tboil | 545.59 | K | Relay (1.0) Calculated Property |
| Tc | 758.76 | K | Relay (1.0) Calculated Property |
| Tfus | 308.93 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 396.20 | K | 0.90 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [212.95; 670.14] | 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 | -9.78600e+01 | |||
| Coefficient B | 1.27020e+00 | |||
| Coefficient C | -4.75000e-04 | |||
| Coefficient D | -2.72000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 212.95 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 290.85 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 362.18 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 426.85 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 484.77 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 535.85 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 580.02 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 617.18 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 647.25 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 670.14 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Cyclododecylamine.
Mixtures
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Thermodynamic study of (heptane + amine) mixtures. III: Excess and partial molar volumes in mixtures with secondary, tertiary, and cyclic amines at 298.15 K
- Joback Method
- McGowan Method
- NIST Webbook
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