- InChI
- InChI=1S/C12H22O4/c13-11(14)9-7-5-3-1-2-4-6-8-10-12(15)16/h1-10H2,(H,13,14)(H,15,16)
- InChI Key
- TVIDDXQYHWJXFK-UHFFFAOYSA-N
- Formula
- C12H22O4
- SMILES
- O=C(O)CCCCCCCCCCC(=O)O
- Molecular Weight1
- 230.30
- CAS
- 693-23-2
- Other Names
-
- 1,10-Decanedicarboxylic acid
- 1,10-decandicarboxylic acid
- 1,12-dodecanedioic acid
- Decamethylenedicarboxylic acid
- Dodecanedicarboxylic acid
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfusH : Enthalpy of fusion at a given temperature (kJ/mol).
- ΔsubH° : Enthalpy of sublimation at standard conditions (kJ/mol).
- ΔsubH : Enthalpy of sublimation at a given temperature (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).
- ΔfusS : Entropy of fusion at a given temperature (J/mol×K).
- 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 | 1.0683 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -6736.20 ± 2.80 | kJ/mol | NIST |
| ΔfG° | -637.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -965.05 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 0.06 | kJ/mol | Vaporization, fusion and sublimation enthalpies of the dicarboxylic acids from C4 to C14 and C16 |
| ΔsubH° | 153.00 ± 3.00 | kJ/mol | NIST |
| ΔvapH° | 130.00 ± 2.30 | kJ/mol | NIST |
| IE | 9.76 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.17 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.057 | Crippen Calculated Property | |
| McVol | 194.820 | ml/mol | McGowan Calculated Property |
| Pc | 2150.00 | kPa | Critical Temperatures and Pressures of Straight-Chain Saturated Dicarboxylic Acids (C4 to C14) |
| Tboil | 573.67 | K | Relay (1.0) Calculated Property |
| Tc | 798.70 | K | Relay (1.0) Calculated Property |
| Tfus | 402.50 ± 0.50 | K | NIST |
| Vc | 0.755 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔfusH | [49.80; 52.50] | kJ/mol | [400.30; 402.50] | 
|
| ΔfusH | 49.80 | kJ/mol | 400.30 | NIST |
| ΔfusH | 52.50 | kJ/mol | 401.60 | NIST |
| ΔfusH | 50.56 | kJ/mol | 402.50 | NIST |
| ΔfusH | 50.57 | kJ/mol | 402.50 | NIST |
| ΔsubH | [153.10; 169.00] | kJ/mol | [307.00; 361.50] |
|
| ΔsubH | 156.00 | kJ/mol | 307.00 | NIST |
| ΔsubH | 153.10 ± 2.90 | kJ/mol | 335.50 | NIST |
| ΔsubH | 153.10 ± 2.90 | kJ/mol | 335.50 | NIST |
| ΔsubH | 169.00 ± 4.00 | kJ/mol | 361.50 | NIST |
| ΔfusS | 125.60 | J/mol×K | 402.50 | NIST |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 518.20 | K | 1.30 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [287.29; 659.98] | 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 | 1.18000e+00 | |||
| Coefficient B | 1.24540e+00 | |||
| Coefficient C | -7.74200e-04 | |||
| Coefficient D | 1.87600e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 287.29 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 353.18 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 411.57 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 463.05 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 508.20 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 547.64 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 581.94 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 611.70 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 637.52 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 659.98 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0040492; 0.0002099] | Pa×s | [402.50; 670.79] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.29086e+01 | |||
| Coefficient B | 2.97824e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 402.50 | |||
| Temperature range, max. | 670.79 | |||
| η | 0.0040492 | Pa×s | 402.50 | Calculated Property |
| η | 0.0024310 | Pa×s | 432.31 | Calculated Property |
| η | 0.0015588 | Pa×s | 462.12 | Calculated Property |
| η | 0.0010548 | Pa×s | 491.93 | Calculated Property |
| η | 0.0007463 | Pa×s | 521.74 | Calculated Property |
| η | 0.0005482 | Pa×s | 551.55 | Calculated Property |
| η | 0.0004156 | Pa×s | 581.36 | Calculated Property |
| η | 0.0003237 | Pa×s | 611.17 | Calculated Property |
| η | 0.0002581 | Pa×s | 640.98 | Calculated Property |
| η | 0.0002099 | Pa×s | 670.79 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [520.47; 712.78] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.56665e+01 | |||
| Coefficient B | -6.09579e+03 | |||
| Coefficient C | -1.24099e+02 | |||
| Temperature range, min. | 520.47 | |||
| Temperature range, max. | 712.78 | |||
| Pvap | 1.33 | kPa | 520.47 | Calculated Property |
| Pvap | 2.93 | kPa | 541.84 | Calculated Property |
| Pvap | 5.96 | kPa | 563.21 | Calculated Property |
| Pvap | 11.34 | kPa | 584.57 | Calculated Property |
| Pvap | 20.40 | kPa | 605.94 | Calculated Property |
| Pvap | 34.91 | kPa | 627.31 | Calculated Property |
| Pvap | 57.18 | kPa | 648.68 | Calculated Property |
| Pvap | 90.10 | kPa | 670.04 | Calculated Property |
| Pvap | 137.21 | kPa | 691.41 | Calculated Property |
| Pvap | 202.66 | kPa | 712.78 | Calculated Property |
Similar Compounds
Find more compounds similar to Dodecanedioic acid.
Mixtures
- Ethanol + Dodecanedioic acid
- Dodecanedioic acid + Acetone
- 3-Pentanone + Dodecanedioic acid
- Dodecanedioic acid + Acetic acid
- 2-Butanone + Dodecanedioic acid
- Dodecanedioic acid + Ethyl Acetate
Sources
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Vaporization, fusion and sublimation enthalpies of the dicarboxylic acids from C4 to C14 and C16
- Measurement and correlation of solubility of dodecanedioic acid in different pure solvents from T = (288.15 to 323.15) K
- Critical Temperatures and Pressures of Straight-Chain Saturated Dicarboxylic Acids (C4 to C14)
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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