- InChI
- InChI=1S/C14H31N/c1-4-5-6-7-8-9-10-11-12-13-14-15(2)3/h4-14H2,1-3H3
- InChI Key
- YWFWDNVOPHGWMX-UHFFFAOYSA-N
- Formula
- C14H31N
- SMILES
- CCCCCCCCCCCCN(C)C
- Molecular Weight1
- 213.41
- CAS
- 112-18-5
- Other Names
-
- 1-Dimethylaminododecane
- 1-Dodecaneamine, N,N-dimethyl
- Adma 12
- Adma 2
- Antioxidant DDA
- Armeen DM 12D
- Barlene 125
- Barlene 12S
- DDA
- DDA (Antioxidant)
- DDA (Corrosion inhibitor)
- Dimethyl Lauramine
- Dimethyl-n-dodecylamine
- Dimethyldodecylamine
- Dodecanamine, N,N-dimethyl
- Dodecylamine, N,N-dimethyl-
- Dodecyldimethylamine
- Empigen AB
- Farmin DM 20
- Farmin DM 2098
- Genamin LA 302D
- Kemamine T-6902
- Lauryldimethylamine
- Monolauryl dimethylamine
- N,N-Dimethyl-1-aminododecane
- N,N-Dimethyl-1-dodecanamine
- N,N-Dimethyl-n-dodecylamine
- N,N-Dimethyldodecanamine
- N,N-Dimethyldodecylamine
- N,N-Dimethyllaurylamine
- N,N-dimethyl-1-dodecamine
- N-Dodecyl-N,N-dimethylamine
- NSC 7332
- Onamine 12
- RC 5629
- n-Dodecyldimethylamine
- n-Lauryldimethylamine
- 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).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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 | 0.6601 | Relay (1.0) Calculated Property | |
| ΔfG° | 177.78 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -270.20 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 72.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.18 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.06 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.469 | Crippen Calculated Property | |
| McVol | 218.100 | ml/mol | McGowan Calculated Property |
| Pc | 1521.12 | kPa | Joback Calculated Property |
| Inp | [1496.00; 1529.00] |
|
|
| Inp | 1529.00 | NIST | |
| Inp | 1496.00 | NIST | |
| Inp | 1509.00 | NIST | |
| Inp | 1529.00 | NIST | |
| Tboil | 533.60 | K | Relay (1.0) Calculated Property |
| Tc | 695.59 | K | Relay (1.0) Calculated Property |
| Tfus | [252.85; 255.65] | K |
|
| Tfus | 255.65 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 252.85 ± 0.50 | K | NIST |
| Vc | 0.874 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | [64.40; 69.50] | kJ/mol | [303.50; 492.00] |
|
| ΔvapH | 69.50 | kJ/mol | 303.50 | NIST |
| ΔvapH | 64.40 | kJ/mol | 492.00 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 384.20 | K | 0.40 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [317.98; 779.63] | 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 | -2.05290e+01 | |||
| Coefficient B | 1.45776e+00 | |||
| Coefficient C | -8.50400e-04 | |||
| Coefficient D | 1.92800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 317.98 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 397.30 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 468.18 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 531.25 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 587.11 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 636.37 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 679.65 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 717.54 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 750.66 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 779.63 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [417.32; 551.26] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.74980e+01 | |||
| Coefficient B | -5.59159e+03 | |||
| Coefficient C | -9.24240e+01 | |||
| Temperature range, min. | 417.32 | |||
| Temperature range, max. | 551.26 | |||
| Pvap | 1.33 | kPa | 417.32 | Calculated Property |
| Pvap | 2.83 | kPa | 432.20 | Calculated Property |
| Pvap | 5.65 | kPa | 447.08 | Calculated Property |
| Pvap | 10.66 | kPa | 461.97 | Calculated Property |
| Pvap | 19.16 | kPa | 476.85 | Calculated Property |
| Pvap | 32.94 | kPa | 491.73 | Calculated Property |
| Pvap | 54.48 | kPa | 506.61 | Calculated Property |
| Pvap | 87.02 | kPa | 521.50 | Calculated Property |
| Pvap | 134.69 | kPa | 536.38 | Calculated Property |
| Pvap | 202.66 | kPa | 551.26 | Calculated Property |
Similar Compounds
Find more compounds similar to 1-Dodecanamine, N,N-dimethyl-.
Sources
- Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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