- InChI
- InChI=1S/C4H8Br2/c5-3-1-2-4-6/h1-4H2
- InChI Key
- ULTHEAFYOOPTTB-UHFFFAOYSA-N
- Formula
- C4H8Br2
- SMILES
- BrCCCCBr
- Molecular Weight1
- 215.91
- CAS
- 110-52-1
- Other Names
-
- 1,4-Butylene bromide
- 1,4-Dibrombutan
- 1,4-Dibromobutane
- BrCH2CH2CH2CH2Br
- DBB
- Dibromo-1,4 butane
- TETRAMETHYLENE DIBROMIDE
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- Cp,liquid : Liquid phase 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).
- ΔfH°liquid : Liquid phase 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).
- n0 : Refractive Index.
- Inp : Non-polar retention indices.
- I : 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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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | 11.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -85.98 | kJ/mol | NIST |
| ΔfH°liquid | -140.10 ± 5.10 | kJ/mol | NIST |
| ΔfusH° | 16.69 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [52.60; 53.09] | kJ/mol |
|
| ΔvapH° | 53.09 | kJ/mol | NIST |
| ΔvapH° | 52.60 | kJ/mol | NIST |
| ΔvapH° | 53.05 | kJ/mol | NIST |
| ΔvapH° | 53.09 ± 0.12 | kJ/mol | NIST |
| IE | [10.15; 10.27] | eV |
|
| IE | 10.15 | eV | NIST |
| IE | 10.27 | eV | NIST |
| log10WS | -2.36 | Crippen Calculated Property | |
| logPoct/wat | 2.556 | Crippen Calculated Property | |
| McVol | 102.220 | ml/mol | McGowan Calculated Property |
| Pc | 4665.71 | kPa | Joback Calculated Property |
| Inp | [1042.00; 1114.00] |
|
|
| Inp | 1094.00 | NIST | |
| Inp | 1114.00 | NIST | |
| Inp | 1057.00 | NIST | |
| Inp | 1094.00 | NIST | |
| Inp | 1042.00 | NIST | |
| Inp | 1084.60 | NIST | |
| Inp | 1057.70 | NIST | |
| I | [1559.00; 1584.00] |
|
|
| I | 1559.00 | NIST | |
| I | 1584.00 | NIST | |
| I | 1561.00 | NIST | |
| I | 1559.00 | NIST | |
| Tboil | [466.00; 471.00] | K |
|
| Tboil | 470.20 | K | NIST |
| Tboil | 466.00 ± 3.00 | K | NIST |
| Tboil | 471.00 ± 3.00 | K | NIST |
| Tc | 629.65 | K | Joback Calculated Property |
| Tfus | 252.10 ± 0.50 | K | NIST |
| Vc | 0.384 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [158.04; 198.06] | J/mol×K | [423.24; 629.65] |
|
|
T(K) Ideal gas heat capacity (J/mol×K) 160 170 180 190 200 450 500 550 600 | ||||
| Cp,gas | 158.04 | J/mol×K | 423.24 | Joback Calculated Property |
| Cp,gas | 165.77 | J/mol×K | 457.64 | Joback Calculated Property |
| Cp,gas | 173.04 | J/mol×K | 492.04 | Joback Calculated Property |
| Cp,gas | 179.88 | J/mol×K | 526.45 | Joback Calculated Property |
| Cp,gas | 186.31 | J/mol×K | 560.85 | Joback Calculated Property |
| Cp,gas | 192.36 | J/mol×K | 595.25 | Joback Calculated Property |
| Cp,gas | 198.06 | J/mol×K | 629.65 | Joback Calculated Property |
| Cp,liquid | [189.62; 202.14] | J/mol×K | [285.15; 355.15] |
|
|
T(K) Liquid phase heat capacity (J/mol×K) 190 192 194 196 198 200 202 300 320 340 | ||||
| Cp,liquid | 189.62 | J/mol×K | 285.15 | Heat Ca... |
| Cp,liquid | 189.85 | J/mol×K | 286.65 | Heat Ca... |
| Cp,liquid | 190.08 | J/mol×K | 288.15 | Heat Ca... |
| Cp,liquid | 190.32 | J/mol×K | 289.65 | Heat Ca... |
| Cp,liquid | 190.55 | J/mol×K | 291.15 | Heat Ca... |
| Cp,liquid | 190.79 | J/mol×K | 292.65 | Heat Ca... |
| Cp,liquid | 191.03 | J/mol×K | 294.15 | Heat Ca... |
| Cp,liquid | 191.27 | J/mol×K | 295.65 | Heat Ca... |
| Cp,liquid | 191.52 | J/mol×K | 297.15 | Heat Ca... |
| Cp,liquid | 191.68 | J/mol×K | 298.15 | Heat Ca... |
| Cp,liquid | 191.20 | J/mol×K | 298.15 | NIST |
| Cp,liquid | 191.76 | J/mol×K | 298.65 | Heat Ca... |
| Cp,liquid | 192.01 | J/mol×K | 300.15 | Heat Ca... |
| Cp,liquid | 192.26 | J/mol×K | 301.65 | Heat Ca... |
| Cp,liquid | 192.51 | J/mol×K | 303.15 | Heat Ca... |
| Cp,liquid | 192.76 | J/mol×K | 304.65 | Heat Ca... |
| Cp,liquid | 193.01 | J/mol×K | 306.15 | Heat Ca... |
| Cp,liquid | 193.26 | J/mol×K | 307.65 | Heat Ca... |
| Cp,liquid | 193.52 | J/mol×K | 309.15 | Heat Ca... |
| Cp,liquid | 193.78 | J/mol×K | 310.65 | Heat Ca... |
| Cp,liquid | 194.04 | J/mol×K | 312.15 | Heat Ca... |
| Cp,liquid | 194.30 | J/mol×K | 313.65 | Heat Ca... |
| Cp,liquid | 194.56 | J/mol×K | 315.15 | Heat Ca... |
| Cp,liquid | 194.82 | J/mol×K | 316.65 | Heat Ca... |
| Cp,liquid | 195.09 | J/mol×K | 318.15 | Heat Ca... |
| Cp,liquid | 195.35 | J/mol×K | 319.65 | Heat Ca... |
| Cp,liquid | 195.62 | J/mol×K | 321.15 | Heat Ca... |
| Cp,liquid | 195.89 | J/mol×K | 322.65 | Heat Ca... |
| Cp,liquid | 196.16 | J/mol×K | 324.15 | Heat Ca... |
| Cp,liquid | 196.44 | J/mol×K | 325.65 | Heat Ca... |
| Cp,liquid | 196.71 | J/mol×K | 327.15 | Heat Ca... |
| Cp,liquid | 196.99 | J/mol×K | 328.65 | Heat Ca... |
| Cp,liquid | 197.27 | J/mol×K | 330.15 | Heat Ca... |
| Cp,liquid | 197.55 | J/mol×K | 331.65 | Heat Ca... |
| Cp,liquid | 197.83 | J/mol×K | 333.15 | Heat Ca... |
| Cp,liquid | 198.11 | J/mol×K | 334.65 | Heat Ca... |
| Cp,liquid | 198.40 | J/mol×K | 336.15 | Heat Ca... |
| Cp,liquid | 198.68 | J/mol×K | 337.65 | Heat Ca... |
| Cp,liquid | 198.97 | J/mol×K | 339.15 | Heat Ca... |
| Cp,liquid | 199.26 | J/mol×K | 340.65 | Heat Ca... |
| Cp,liquid | 199.55 | J/mol×K | 342.15 | Heat Ca... |
| Cp,liquid | 199.84 | J/mol×K | 343.65 | Heat Ca... |
| Cp,liquid | 200.14 | J/mol×K | 345.15 | Heat Ca... |
| Cp,liquid | 200.43 | J/mol×K | 346.65 | Heat Ca... |
| Cp,liquid | 200.73 | J/mol×K | 348.15 | Heat Ca... |
| Cp,liquid | 201.03 | J/mol×K | 349.65 | Heat Ca... |
| Cp,liquid | 201.33 | J/mol×K | 351.15 | Heat Ca... |
| Cp,liquid | 201.63 | J/mol×K | 352.65 | Heat Ca... |
| Cp,liquid | 201.93 | J/mol×K | 354.15 | Heat Ca... |
| Cp,liquid | 202.14 | J/mol×K | 355.15 | Heat Ca... |
| η | [0.0004394; 0.0031503] | Pa×s | [254.44; 423.24] |
|
|
T(K) Dynamic viscosity (Pa×s) 5.00e-4 1.00e-3 1.50e-3 2.00e-3 2.50e-3 3.00e-3 300 350 400 | ||||
| η | 0.0031503 | Pa×s | 254.44 | Joback Calculated Property |
| η | 0.0019266 | Pa×s | 282.57 | Joback Calculated Property |
| η | 0.0012880 | Pa×s | 310.71 | Joback Calculated Property |
| η | 0.0009206 | Pa×s | 338.84 | Joback Calculated Property |
| η | 0.0006928 | Pa×s | 366.97 | Joback Calculated Property |
| η | 0.0005429 | Pa×s | 395.11 | Joback Calculated Property |
| η | 0.0004394 | Pa×s | 423.24 | Joback Calculated Property |
| ΔvapH | [49.40; 51.40] | kJ/mol | [387.50; 447.50] |
|
| ΔvapH | 49.40 | kJ/mol | 387.50 | NIST |
| ΔvapH | 51.40 | kJ/mol | 447.50 | NIST |
| n0 | 1.51630 | 298.15 | Thermod... | |
| γ | [0.04; 0.04] | N/m | [293.15; 313.15] |
|
|
T(K) Surface Tension (N/m) 0.04 0.04 0.04 0.04 0.04 0.04 295 300 305 310 | ||||
| γ | 0.04 | N/m | 293.15 | The add... |
| γ | 0.04 | N/m | 298.15 | The add... |
| γ | 0.04 | N/m | 303.15 | The add... |
| γ | 0.04 | N/m | 308.15 | The add... |
| γ | 0.04 | N/m | 313.15 | The add... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | [337.20; 338.00] | K | [0.80; 0.80] |
|
| Tboilr | 337.20 | K | 0.80 | NIST |
| Tboilr | 338.00 | K | 0.80 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [353.08; 498.51] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.51599e+01 | |||
| Coefficient B | -4.23974e+03 | |||
| Coefficient C | -6.80070e+01 | |||
| Temperature range, min. | 353.08 | |||
| Temperature range, max. | 498.51 | |||
|
T(K) Vapor pressure (kPa) 0 50 100 150 200 350 400 450 500 | ||||
| Pvap | 1.33 | kPa | 353.08 | Calculated Property |
| Pvap | 2.96 | kPa | 369.24 | Calculated Property |
| Pvap | 6.06 | kPa | 385.40 | Calculated Property |
| Pvap | 11.58 | kPa | 401.56 | Calculated Property |
| Pvap | 20.83 | kPa | 417.72 | Calculated Property |
| Pvap | 35.58 | kPa | 433.87 | Calculated Property |
| Pvap | 58.08 | kPa | 450.03 | Calculated Property |
| Pvap | 91.12 | kPa | 466.19 | Calculated Property |
| Pvap | 138.03 | kPa | 482.35 | Calculated Property |
| Pvap | 202.66 | kPa | 498.51 | Calculated Property |
| Pvap | [4.00; 320.55] | kPa | [375.15; 520.15] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 9.74283e+01 | |||
| Coefficient B | -1.01050e+04 | |||
| Coefficient C | -1.17919e+01 | |||
| Coefficient D | 5.60527e-06 | |||
| Temperature range, min. | 375.15 | |||
| Temperature range, max. | 520.15 | |||
|
T(K) Vapor pressure (kPa) 0 50 100 150 200 250 300 350 400 450 500 | ||||
| Pvap | 4.00 | kPa | 375.15 | Calculated Property |
| Pvap | 7.92 | kPa | 391.26 | Calculated Property |
| Pvap | 14.69 | kPa | 407.37 | Calculated Property |
| Pvap | 25.76 | kPa | 423.48 | Calculated Property |
| Pvap | 42.98 | kPa | 439.59 | Calculated Property |
| Pvap | 68.71 | kPa | 455.71 | Calculated Property |
| Pvap | 105.76 | kPa | 471.82 | Calculated Property |
| Pvap | 157.45 | kPa | 487.93 | Calculated Property |
| Pvap | 227.60 | kPa | 504.04 | Calculated Property |
| Pvap | 320.55 | kPa | 520.15 | Calculated Property |
Similar Compounds
Find more compounds similar to Butane, 1,4-dibromo-.
Mixtures
- Ethyl formate + Butane, 1,4-dibromo-
- Ethyl Acetate + Butane, 1,4-dibromo-
- Propanoic acid, ethyl ester + Butane, 1,4-dibromo-
- Butanoic acid, ethyl ester + Butane, 1,4-dibromo-
- Pentanoic acid, ethyl ester + Butane, 1,4-dibromo-
- Methyl formate + Butane, 1,4-dibromo-
- Acetic acid, methyl ester + Butane, 1,4-dibromo-
- Methyl propionate + Butane, 1,4-dibromo-
- Butanoic acid, methyl ester + Butane, 1,4-dibromo-
- Methyl valerate + Butane, 1,4-dibromo-
- Formic acid, butyl ester + Butane, 1,4-dibromo-
- Acetic acid, butyl ester + Butane, 1,4-dibromo-
- Propanoic acid, butyl ester + Butane, 1,4-dibromo-
- Butanoic acid, butyl ester + Butane, 1,4-dibromo-
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Crippen Method
- Thermodynamic study of (alkyl esters + a,x-alkyl dihalides) II: HE m and V E m for 25 binary mixtures {xCu-1H2u-1CO2C2H5 + (1 - x)a,x-BrCH2(CH2)v-2CH2Br}, where u = 1 to 5, a = 1 and v = x = 2 to 6
- Thermodynamic study of (alkyl esters + alpha,omega-alkyl dihalides) IV: Hex and Vex for 25 binary mixtures {xC(u-1)H(2u-1)CO2CH3 + (1-x)alpha,omega-BrCH2(CH2)(v-2)CH2Br}, where u = 1 to 5, alpha = 1 and v = omega = 2 to 6
- Thermodynamic study of (alkyl esters + alpha,beta-alkyl dihalides) VI.H and V for 20 binary mixtures {xCu-1H2u-1CO2(CH2)3CH3 + (1 - x)alpha,omega-BrCH2(CH2)v-2CH2Br}, where u = 1 to 5, alpha = 1, and v = omega = 2 to 6
- The additivity of surface and volumetric properties of alpha,omega-dihalogenoalkanes
- Heat Capacity of alpha,omega-Bromochloroalkanes and ?,?-Dibromoalkanes: Their Dependence on the Hydrocarbon Chain Length and Temperature (285.15 to 355.15) K
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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