- InChI
- InChI=1S/C6H12Cl2/c7-5-3-1-2-4-6-8/h1-6H2
- InChI Key
- OVISMSJCKCDOPU-UHFFFAOYSA-N
- Formula
- C6H12Cl2
- SMILES
- ClCCCCCCCl
- Molecular Weight1
- 155.06
- CAS
- 2163-00-0
- Other Names
-
- 1,6-dichlorohexane
- hexamethylene dichloride
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase heat capacity (J/mol×K).
- Csat : Molar heat capacity at saturation pressure (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).
- Pvap : Vapor pressure (kPa).
- n0 : Refractive Index.
- ρl : Liquid Density (kg/m3).
- Ip : Polar retention indices.
- γ : Surface Tension (N/m).
- 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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Contents
- Physical Properties
- Temperature Dependent Properties
- Pressure Dependent Properties
- Datasets
- Correlations
- Similar Compounds
- Mixtures
- Sources
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.4227 | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value | |
| ΔfG° | -24.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -216.61 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 56.30 | kJ/mol | NIST |
| IE | 10.31 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.76 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.024 | Crippen Calculated Property | |
| McVol | 119.880 | ml/mol | McGowan Calculated Property |
| Pc | 2930.32 | kPa | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Ip | [1536.00; 1536.00] |
|
|
| Ip | 1536.00 | NIST | |
| Ip | 1536.00 | NIST | |
| Tboil | 477.20 | K | NIST |
| Tc | 692.50 | K | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Tfus | 260.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Vc | 0.461 | m3/kmol | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
Temperature Dependent Properties
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [361.00; 361.70] | K | [2.00; 2.00] |
|
| Tboilr | 361.70 | K | 2.00 | NIST |
| Tboilr | 361.00 | K | 2.00 | NIST |
Datasets
Mass density, kg/m3
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Pressure, kPa - Liquid | Mass density, kg/m3 - Liquid |
| 288.15 | 100.00 | 1073.7 |
| 288.15 | 500.00 | 1073.9 |
| 288.15 | 1000.00 | 1074.3 |
| 288.15 | 1600.00 | 1074.6 |
| 288.15 | 2000.00 | 1075.0 |
| 288.15 | 2500.00 | 1075.3 |
| 288.15 | 3100.00 | 1075.7 |
| 288.15 | 3600.00 | 1076.0 |
| 288.15 | 4100.00 | 1076.3 |
| 288.15 | 4600.00 | 1076.6 |
| 288.15 | 5100.00 | 1076.9 |
| 288.15 | 5600.00 | 1077.3 |
| 288.15 | 6100.00 | 1077.6 |
| 288.15 | 6500.00 | 1077.9 |
| 288.15 | 7100.00 | 1078.3 |
| 288.15 | 7600.00 | 1078.5 |
| 288.15 | 8100.00 | 1078.9 |
| 288.15 | 8600.00 | 1079.2 |
| 288.15 | 9100.00 | 1079.5 |
| 288.15 | 9600.00 | 1079.9 |
| 288.15 | 10100.00 | 1080.2 |
| 288.15 | 10600.00 | 1080.5 |
| 288.15 | 11100.00 | 1080.8 |
| 288.15 | 11600.00 | 1081.2 |
| 288.15 | 12100.00 | 1081.5 |
| 288.15 | 12600.00 | 1081.8 |
| 288.15 | 13100.00 | 1082.1 |
| 288.15 | 13600.00 | 1082.4 |
| 288.15 | 14200.00 | 1082.8 |
| 288.15 | 14700.00 | 1083.0 |
| 288.15 | 15200.00 | 1083.4 |
| 288.15 | 15700.00 | 1083.7 |
| 288.15 | 16300.00 | 1084.0 |
| 288.15 | 16800.00 | 1084.3 |
| 288.15 | 17300.00 | 1084.6 |
| 288.15 | 17800.00 | 1084.9 |
| 288.15 | 18300.00 | 1085.3 |
| 288.15 | 18800.00 | 1085.5 |
| 288.15 | 19200.00 | 1085.7 |
| 288.15 | 19700.00 | 1086.0 |
| 288.15 | 20200.00 | 1086.5 |
| 298.15 | 100.00 | 1063.8 |
| 298.15 | 500.00 | 1064.2 |
| 298.15 | 1000.00 | 1064.4 |
| 298.15 | 1500.00 | 1064.8 |
| 298.15 | 2000.00 | 1065.2 |
| 298.15 | 2500.00 | 1065.5 |
| 298.15 | 3100.00 | 1065.9 |
| 298.15 | 3600.00 | 1066.3 |
| 298.15 | 4100.00 | 1066.7 |
| 298.15 | 4500.00 | 1066.9 |
| 298.15 | 5000.00 | 1067.3 |
| 298.15 | 5600.00 | 1067.6 |
| 298.15 | 6100.00 | 1068.0 |
| 298.15 | 6600.00 | 1068.4 |
| 298.15 | 7100.00 | 1068.7 |
| 298.15 | 7600.00 | 1069.0 |
| 298.15 | 8100.00 | 1069.4 |
| 298.15 | 8600.00 | 1069.7 |
| 298.15 | 9200.00 | 1070.1 |
| 298.15 | 9600.00 | 1070.4 |
| 298.15 | 10100.00 | 1070.7 |
| 298.15 | 10600.00 | 1071.1 |
| 298.15 | 11000.00 | 1071.3 |
| 298.15 | 11700.00 | 1071.7 |
| 298.15 | 12100.00 | 1071.9 |
| 298.15 | 12600.00 | 1072.3 |
| 298.15 | 13100.00 | 1072.6 |
| 298.15 | 13600.00 | 1072.9 |
| 298.15 | 14200.00 | 1073.3 |
| 298.15 | 14700.00 | 1073.6 |
| 298.15 | 15200.00 | 1074.0 |
| 298.15 | 15700.00 | 1074.3 |
| 298.15 | 16400.00 | 1074.8 |
| 298.15 | 16800.00 | 1075.2 |
| 298.15 | 17300.00 | 1075.5 |
| 298.15 | 17800.00 | 1075.8 |
| 298.15 | 18300.00 | 1076.1 |
| 298.15 | 18700.00 | 1076.4 |
| 298.15 | 19200.00 | 1076.7 |
| 298.15 | 19700.00 | 1076.9 |
| 298.15 | 20200.00 | 1077.3 |
| 308.15 | 100.00 | 1054.6 |
| 308.15 | 500.00 | 1054.9 |
| 308.15 | 1000.00 | 1055.2 |
| 308.15 | 1500.00 | 1055.5 |
| 308.15 | 2000.00 | 1055.9 |
| 308.15 | 2500.00 | 1056.3 |
| 308.15 | 3100.00 | 1056.7 |
| 308.15 | 3600.00 | 1057.1 |
| 308.15 | 4100.00 | 1057.4 |
| 308.15 | 4600.00 | 1057.8 |
| 308.15 | 5100.00 | 1058.2 |
| 308.15 | 5600.00 | 1058.5 |
| 308.15 | 6100.00 | 1058.9 |
| 308.15 | 6600.00 | 1059.2 |
| 308.15 | 7100.00 | 1059.6 |
| 308.15 | 7600.00 | 1059.8 |
| 308.15 | 8100.00 | 1060.2 |
| 308.15 | 8600.00 | 1060.6 |
| 308.15 | 9200.00 | 1061.0 |
| 308.15 | 9600.00 | 1061.4 |
| 308.15 | 10100.00 | 1061.7 |
| 308.15 | 10600.00 | 1062.1 |
| 308.15 | 11100.00 | 1062.4 |
| 308.15 | 11600.00 | 1062.7 |
| 308.15 | 12100.00 | 1063.1 |
| 308.15 | 12600.00 | 1063.5 |
| 308.15 | 13100.00 | 1063.8 |
| 308.15 | 13600.00 | 1064.1 |
| 308.15 | 14100.00 | 1064.5 |
| 308.15 | 14800.00 | 1064.9 |
| 308.15 | 15100.00 | 1065.1 |
| 308.15 | 15700.00 | 1065.5 |
| 308.15 | 16200.00 | 1065.8 |
| 308.15 | 16700.00 | 1066.2 |
| 308.15 | 17300.00 | 1066.6 |
| 308.15 | 17800.00 | 1066.9 |
| 308.15 | 18300.00 | 1067.2 |
| 308.15 | 18700.00 | 1067.4 |
| 308.15 | 19200.00 | 1067.8 |
| 308.15 | 19700.00 | 1068.0 |
| 308.15 | 20300.00 | 1068.5 |
| 318.15 | 100.00 | 1045.1 |
| 318.15 | 500.00 | 1045.3 |
| 318.15 | 1000.00 | 1045.7 |
| 318.15 | 1500.00 | 1046.2 |
| 318.15 | 2000.00 | 1046.6 |
| 318.15 | 2500.00 | 1046.9 |
| 318.15 | 3100.00 | 1047.4 |
| 318.15 | 3600.00 | 1047.8 |
| 318.15 | 4100.00 | 1048.1 |
| 318.15 | 4600.00 | 1048.4 |
| 318.15 | 5100.00 | 1048.9 |
| 318.15 | 5600.00 | 1049.2 |
| 318.15 | 6100.00 | 1049.7 |
| 318.15 | 6600.00 | 1050.0 |
| 318.15 | 7100.00 | 1050.4 |
| 318.15 | 7600.00 | 1050.7 |
| 318.15 | 8100.00 | 1051.2 |
| 318.15 | 8500.00 | 1051.4 |
| 318.15 | 9100.00 | 1051.8 |
| 318.15 | 9600.00 | 1052.2 |
| 318.15 | 10100.00 | 1052.6 |
| 318.15 | 10700.00 | 1053.1 |
| 318.15 | 11100.00 | 1053.6 |
| 318.15 | 11600.00 | 1053.9 |
| 318.15 | 12100.00 | 1054.1 |
| 318.15 | 12600.00 | 1054.5 |
| 318.15 | 13100.00 | 1054.8 |
| 318.15 | 13600.00 | 1055.3 |
| 318.15 | 14200.00 | 1055.6 |
| 318.15 | 14700.00 | 1056.0 |
| 318.15 | 15200.00 | 1056.3 |
| 318.15 | 15600.00 | 1056.6 |
| 318.15 | 16300.00 | 1057.1 |
| 318.15 | 16800.00 | 1057.3 |
| 318.15 | 17300.00 | 1057.7 |
| 318.15 | 17800.00 | 1058.0 |
| 318.15 | 18300.00 | 1058.3 |
| 318.15 | 18900.00 | 1058.8 |
| 318.15 | 19200.00 | 1059.0 |
| 318.15 | 19700.00 | 1059.3 |
| 318.15 | 20200.00 | 1059.6 |
| Reference | ||
| Fixed | Measured | |
|---|---|---|
| Temperature, K - Liquid | Pressure, kPa - Liquid | Mass density, kg/m3 - Liquid |
| 298.15 | 100.00 | 1063.8 |
| Reference | ||
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [159.57; 345.42] | 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 | 2.32160e+01 | |||
| Coefficient B | 5.87400e-01 | |||
| Coefficient C | -3.43400e-04 | |||
| Coefficient D | 7.82000e-08 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 159.57 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 191.51 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 220.04 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 245.43 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 267.91 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 287.73 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 305.15 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 320.40 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 333.74 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 345.42 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0018399; 0.0002102] | Pa×s | [260.15; 484.75] |
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 | -1.09801e+01 | |||
| Coefficient B | 1.21804e+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. | 260.15 | |||
| Temperature range, max. | 484.75 | |||
| η | 0.0018399 | Pa×s | 260.15 | Calculated Property |
| η | 0.0012212 | Pa×s | 285.11 | Calculated Property |
| η | 0.0008659 | Pa×s | 310.06 | Calculated Property |
| η | 0.0006462 | Pa×s | 335.02 | Calculated Property |
| η | 0.0005022 | Pa×s | 359.97 | Calculated Property |
| η | 0.0004033 | Pa×s | 384.93 | Calculated Property |
| η | 0.0003326 | Pa×s | 409.88 | Calculated Property |
| η | 0.0002805 | Pa×s | 434.84 | Calculated Property |
| η | 0.0002409 | Pa×s | 459.79 | Calculated Property |
| η | 0.0002102 | Pa×s | 484.75 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [366.72; 503.12] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.61007e+01 | |||
| Coefficient B | -4.63200e+03 | |||
| Coefficient C | -7.37980e+01 | |||
| Temperature range, min. | 366.72 | |||
| Temperature range, max. | 503.12 | |||
| Pvap | 1.33 | kPa | 366.72 | Calculated Property |
| Pvap | 2.90 | kPa | 381.88 | Calculated Property |
| Pvap | 5.87 | kPa | 397.03 | Calculated Property |
| Pvap | 11.16 | kPa | 412.19 | Calculated Property |
| Pvap | 20.07 | kPa | 427.34 | Calculated Property |
| Pvap | 34.38 | kPa | 442.50 | Calculated Property |
| Pvap | 56.47 | kPa | 457.65 | Calculated Property |
| Pvap | 89.30 | kPa | 472.81 | Calculated Property |
| Pvap | 136.56 | kPa | 487.96 | Calculated Property |
| Pvap | 202.67 | kPa | 503.12 | Calculated Property |
Similar Compounds
Find more compounds similar to Hexane, 1,6-dichloro-.
Mixtures
- Methyl formate + Hexane, 1,6-dichloro-
- Ethyl formate + Hexane, 1,6-dichloro-
- Formic acid, propyl ester + Hexane, 1,6-dichloro-
- Formic acid, butyl ester + Hexane, 1,6-dichloro-
- Formic acid, pentyl ester + Hexane, 1,6-dichloro-
- Propanoic acid, butyl ester + Hexane, 1,6-dichloro-
- Acetic acid, butyl ester + Hexane, 1,6-dichloro-
- Butanoic acid, butyl ester + Hexane, 1,6-dichloro-
- Ethyl Acetate + Hexane, 1,6-dichloro-
- Butanoic acid, ethyl ester + Hexane, 1,6-dichloro-
- Pentanoic acid, ethyl ester + Hexane, 1,6-dichloro-
- Propanoic acid, ethyl ester + Hexane, 1,6-dichloro-
- 2-Pyrrolidinone, 1-methyl- + Hexane, 1,6-dichloro-
- Formamide, N,N-dimethyl- + Hexane, 1,6-dichloro-
- N,N-Dimethylacetamide + Hexane, 1,6-dichloro-
- Acetic acid, propyl ester + Hexane, 1,6-dichloro-
- Propanoic acid, propyl ester + Hexane, 1,6-dichloro-
- Butanoic acid, propyl ester + Hexane, 1,6-dichloro-
- Heptane + Hexane, 1,6-dichloro-
- Dodecane + Hexane, 1,6-dichloro-
Find more mixtures with Hexane, 1,6-dichloro-.
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).
- PSRK revision IV (2005), critical constants and acentric factors of 1000 components ChEDL chemicals 1.5.2, from Horstmann, S.; Jabłoniec, A.; Krafczyk, J.; Fischer, K.; Gmehling, J. PSRK Group Contribution Equation of State: Comprehensive Revision and Extension IV, Including Critical Constants and α-Function Parameters for 1000 Components. Fluid Phase Equilib. 2005, 227, 157-164.
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Thermodynamic study of (alkyl esters + a,x-alkyl dihalides) I: HE and V E for 25 binary mixtures {xCu-1H2u-1CO2C2H5 + (1-x)a,x-ClCH2(CH2)v-2CH2Cl}, where u = 1 to 5, a = 1 and v = x = 2 to 6
- Thermodynamic study of (alkyl esters + a,x-alkyl dihalides)III. HE m and V E m for 20 binary mixtures {xCu-1H2u-1CO2C4H9 + (1 - x)a,x-ClCH2(CH2)v-2CH2Cl}, where u = 1 to 4, a = 1 and v = x = 2 to 6
- Thermodynamic study of (alkyl esters + a,x-alkyl dihalides) V. Hex and Vex for 25 binary mixtures {xCu-1H2u-1CO2CH3 + (1-x)a,x-ClCH2(CH2)v-2CH2Cl}, where u = 1 to 5, a = 1 and v = x = 2 to 6
- Excess molar enthalpies and (vapour + liquid) equilibria for mixtures containing N,N-dialkylamides and a,x-dichloroalkanes
- Excess enthalpies and isothermal (vapour + liquid) equilibria of (1-methyl-2-pyrrolidone + 1-chloroalkane or +,?-dichloroalkane) mixtures
- Thermodynamic study of (alkyl esters + a,x-alkyl dihalides) VII. HE m and VE m for 20 binary mixtures {xCu 1H2u 1CO2C3H7 + (1 x)a,x-ClCH2(CH2)v 2CH2Cl}, where u = 1 to 4, a = 1 and v = x = 2 to 6. An analysis of behavior using the COSMO-RS methodology
- The additivity of surface and volumetric properties of alpha,omega-dihalogenoalkanes
- Heat Capacities of alpha,omega-Dichloroalkanes at Temperatures from 284.15 K to 353.15 K and a Group Additivity Analysis
- Heat Capacities, Densities, and Speeds of Sound for {(1,5-Dichloropentane or 1,6-Dichlorohexane) + Dodecane}
- Thermodynamic and Acoustic Properties of Mixtures of 1,6-Dichlorohexane with Heptane from (293 to 313) K
- Densities and Isothermal Compressibilities at Pressures up to 20 MPa of the Systems N,N-Dimethylformamide or N,N-Dimethylacetamide + r,o-Dichloroalkane
- Densities and Isothermal Compressibilities at Pressures up to 20 MPa of the Systems 1-Methyl-2-pyrrolidone + 1-Chloroalkane or + r,u-Dichloroalkane
- Joback Method
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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