- InChI
- InChI=1S/C20H30O6/c1-3-5-11-23-13-15-25-19(21)17-9-7-8-10-18(17)20(22)26-16-14-24-12-6-4-2/h7-10H,3-6,11-16H2,1-2H3
- InChI Key
- CMCJNODIWQEOAI-UHFFFAOYSA-N
- Formula
- C20H30O6
- SMILES
-
CCCCOCCOC(=O)c1ccccc1C(=O)OCCO
CCCC - Molecular Weight1
- 366.45
- CAS
- 117-83-9
- Other Names
-
- 1,2-Benzenedicarboxylic acid, 1,2-bis(2-butoxyethyl) ester
- 1,2-Benzenedicarboxylic acid, bis(2-butoxyethyl) ester
- Butyl ''cellosolve'' phthalate
- Butyl glycol phthalate
- DBEP
- Di-(2-butoxyethyl)ester kyseliny ftalove
- Dibutyl cellosolve phthalate
- Dibutylcellosolve ftalat
- Dibutylglycol phthalate
- Ethanol, 2-butoxy-, phthalate (2:1)
- Kesscoflex
- Kesscoflex BCP
- Kronisol
- NSC 4840
- Palatinol K
- Phthalic acid dibutoxy ethyl ester
- Phthalic acid, bis(2-butoxyethyl) ester
- Phthalic acid, di(2-butoxyethyl) ester
- Plasthall 200DBEP
- Plasthall DBEP
- bis (butyl glycol) phthalate
- bis(2-n-butoxyethyl) phthalate
- di(Butoxyethyl)phthalate
- n-Butyl glycol phthalate
- «beta»-Butoxyethyl phthalate
- ω : Acentric Factor.
- 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).
- 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).
- 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 | 1.0794 | Relay (1.0) Calculated Property | |
| ΔfG° | -610.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -1064.27 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 52.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.96 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.08 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.25 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.634 | Crippen Calculated Property | |
| McVol | 295.520 | ml/mol | McGowan Calculated Property |
| Pc | 1234.61 | kPa | Joback Calculated Property |
| Inp | [2484.00; 2496.00] |
|
|
| Inp | Outlier 2496.00 | NIST | |
| Inp | 2484.00 | NIST | |
| Inp | 2485.00 | NIST | |
| Inp | 2485.00 | NIST | |
| Inp | 2485.00 | NIST | |
| Inp | 2486.00 | NIST | |
| Inp | 2486.00 | NIST | |
| Inp | 2488.00 | NIST | |
| Inp | Outlier 2496.00 | NIST | |
| Inp | 2484.00 | NIST | |
| Inp | 2486.00 | NIST | |
| Tboil | 658.33 | K | Relay (1.0) Calculated Property |
| Tc | 851.16 | K | Relay (1.0) Calculated Property |
| Tfus | 218.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Vc | 1.103 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [438.53; 982.80] | 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 | 6.69200e+01 | |||
| Coefficient B | 1.52944e+00 | |||
| Coefficient C | -6.17160e-04 | |||
| Coefficient D | 3.60000e-09 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 438.53 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 530.92 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 615.30 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 691.69 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 760.09 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 820.53 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 873.01 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 917.54 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 954.13 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 982.80 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [1.2866220; 0.0000431] | Pa×s | [218.15; 733.50] |
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 | -1.44141e+01 | |||
| Coefficient B | 3.19942e+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. | 218.15 | |||
| Temperature range, max. | 733.50 | |||
| η | 1.2866220 | Pa×s | 218.15 | Calculated Property |
| η | 0.0609788 | Pa×s | 275.41 | Calculated Property |
| η | 0.0082563 | Pa×s | 332.67 | Calculated Property |
| η | 0.0020111 | Pa×s | 389.93 | Calculated Property |
| η | 0.0007033 | Pa×s | 447.19 | Calculated Property |
| η | 0.0003122 | Pa×s | 504.45 | Calculated Property |
| η | 0.0001636 | Pa×s | 561.72 | Calculated Property |
| η | 0.0000966 | Pa×s | 618.98 | Calculated Property |
| η | 0.0000623 | Pa×s | 676.24 | Calculated Property |
| η | 0.0000431 | Pa×s | 733.50 | Calculated Property |
Similar Compounds
Find more compounds similar to Bis(2-butoxyethyl) phthalate.
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
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