- InChI
- InChI=1S/C10H21Br/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
- InChI Key
- MYMSJFSOOQERIO-UHFFFAOYSA-N
- Formula
- C10H21Br
- SMILES
- CCCCCCCCCCBr
- Molecular Weight1
- 221.18
- CAS
- 112-29-8
- Other Names
-
- 1-Bromodecane
- 1-Decyl bromide
- Decyl bromide
- N-DECYL BROMIDE
- 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).
- 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).
- 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.
- I : Polar retention indices.
- csound,fluid : Speed of sound in fluid (m/s).
- 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° | 47.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -223.40 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.94 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.77 ± 0.38 | kJ/mol | NIST |
| log10WS | -4.44 | Crippen Calculated Property | |
| logPoct/wat | 4.522 | Crippen Calculated Property | |
| McVol | 169.260 | ml/mol | McGowan Calculated Property |
| Pc | 2248.26 | kPa | Joback Calculated Property |
| Inp | [1326.00; 1370.00] |
|
|
| Inp | 1326.00 | NIST | |
| Inp | 1344.00 | NIST | |
| Inp | Outlier 1370.00 | NIST | |
| Inp | 1345.00 | NIST | |
| Inp | 1332.00 | NIST | |
| Inp | 1326.00 | NIST | |
| Inp | 1344.00 | NIST | |
| Inp | 1326.00 | NIST | |
| Inp | 1345.00 | NIST | |
| I | [1578.00; 1583.00] |
|
|
| I | 1583.00 | NIST | |
| I | 1579.00 | NIST | |
| I | 1578.00 | NIST | |
| I | 1578.00 | NIST | |
| Tboil | [511.00; 513.80] | K |
|
| Tboil | 511.20 | K | NIST |
| Tboil | 511.00 | K | NIST |
| Tboil | 513.80 | K | NIST |
| Tc | 672.07 | K | Joback Calculated Property |
| Tfus | [243.95; 244.00] | K |
|
| Tfus | 243.95 | K | KDB |
| Tfus | 244.00 ± 0.30 | K | NIST |
| Vc | 0.657 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [364.97; 444.56] | J/mol×K | [494.36; 672.07] |
|
|
T(K) Ideal gas heat capacity (J/mol×K) 360 380 400 420 440 500 550 600 650 | ||||
| Cp,gas | 364.97 | J/mol×K | 494.36 | Joback Calculated Property |
| Cp,gas | 379.77 | J/mol×K | 523.98 | Joback Calculated Property |
| Cp,gas | 393.94 | J/mol×K | 553.60 | Joback Calculated Property |
| Cp,gas | 407.47 | J/mol×K | 583.21 | Joback Calculated Property |
| Cp,gas | 420.41 | J/mol×K | 612.83 | Joback Calculated Property |
| Cp,gas | 432.76 | J/mol×K | 642.45 | Joback Calculated Property |
| Cp,gas | 444.56 | J/mol×K | 672.07 | Joback Calculated Property |
| Cp,liquid | [332.60; 396.77] | J/mol×K | [284.15; 423.15] |
|
|
T(K) Liquid phase heat capacity (J/mol×K) 330 340 350 360 370 380 390 400 300 350 400 | ||||
| Cp,liquid | 332.60 | J/mol×K | 284.15 | Heat Ca... |
| Cp,liquid | 333.65 | J/mol×K | 286.65 | Heat Ca... |
| Cp,liquid | 335.00 | J/mol×K | 289.15 | Heat Ca... |
| Cp,liquid | 336.08 | J/mol×K | 291.65 | Heat Ca... |
| Cp,liquid | 336.90 | J/mol×K | 294.15 | Heat Ca... |
| Cp,liquid | 338.20 | J/mol×K | 296.65 | Heat Ca... |
| Cp,liquid | 334.38 | J/mol×K | 298.15 | Isobari... |
| Cp,liquid | 339.29 | J/mol×K | 299.15 | Heat Ca... |
| Cp,liquid | 340.37 | J/mol×K | 301.65 | Heat Ca... |
| Cp,liquid | 336.85 | J/mol×K | 303.15 | Isobari... |
| Cp,liquid | 341.48 | J/mol×K | 304.15 | Heat Ca... |
| Cp,liquid | 342.74 | J/mol×K | 306.65 | Heat Ca... |
| Cp,liquid | 339.35 | J/mol×K | 308.15 | Isobari... |
| Cp,liquid | 343.89 | J/mol×K | 309.15 | Heat Ca... |
| Cp,liquid | 345.13 | J/mol×K | 311.65 | Heat Ca... |
| Cp,liquid | 341.85 | J/mol×K | 313.15 | Isobari... |
| Cp,liquid | 346.34 | J/mol×K | 314.15 | Heat Ca... |
| Cp,liquid | 347.51 | J/mol×K | 316.65 | Heat Ca... |
| Cp,liquid | 344.35 | J/mol×K | 318.15 | Isobari... |
| Cp,liquid | 348.84 | J/mol×K | 319.15 | Heat Ca... |
| Cp,liquid | 350.10 | J/mol×K | 321.65 | Heat Ca... |
| Cp,liquid | 346.85 | J/mol×K | 323.15 | Isobari... |
| Cp,liquid | 351.41 | J/mol×K | 324.15 | Heat Ca... |
| Cp,liquid | 352.71 | J/mol×K | 326.65 | Heat Ca... |
| Cp,liquid | 349.35 | J/mol×K | 328.15 | Isobari... |
| Cp,liquid | 354.02 | J/mol×K | 329.15 | Heat Ca... |
| Cp,liquid | 355.32 | J/mol×K | 331.65 | Heat Ca... |
| Cp,liquid | 351.85 | J/mol×K | 333.15 | Isobari... |
| Cp,liquid | 356.14 | J/mol×K | 334.15 | Heat Ca... |
| Cp,liquid | 357.34 | J/mol×K | 336.65 | Heat Ca... |
| Cp,liquid | 354.33 | J/mol×K | 338.15 | Isobari... |
| Cp,liquid | 359.30 | J/mol×K | 339.15 | Heat Ca... |
| Cp,liquid | 360.70 | J/mol×K | 341.65 | Heat Ca... |
| Cp,liquid | 356.83 | J/mol×K | 343.15 | Isobari... |
| Cp,liquid | 362.13 | J/mol×K | 344.15 | Heat Ca... |
| Cp,liquid | 363.37 | J/mol×K | 346.65 | Heat Ca... |
| Cp,liquid | 359.33 | J/mol×K | 348.15 | Isobari... |
| Cp,liquid | 364.86 | J/mol×K | 349.15 | Heat Ca... |
| Cp,liquid | 366.38 | J/mol×K | 351.65 | Heat Ca... |
| Cp,liquid | 361.82 | J/mol×K | 353.15 | Isobari... |
| Cp,liquid | 367.07 | J/mol×K | 353.15 | Heat Ca... |
| Cp,liquid | 364.32 | J/mol×K | 358.15 | Isobari... |
| Cp,liquid | 366.82 | J/mol×K | 363.15 | Isobari... |
| Cp,liquid | 369.32 | J/mol×K | 368.15 | Isobari... |
| Cp,liquid | 371.80 | J/mol×K | 373.15 | Isobari... |
| Cp,liquid | 374.30 | J/mol×K | 378.15 | Isobari... |
| Cp,liquid | 376.80 | J/mol×K | 383.15 | Isobari... |
| Cp,liquid | 379.30 | J/mol×K | 388.15 | Isobari... |
| Cp,liquid | 381.80 | J/mol×K | 393.15 | Isobari... |
| Cp,liquid | 384.30 | J/mol×K | 398.15 | Isobari... |
| Cp,liquid | 386.80 | J/mol×K | 403.15 | Isobari... |
| Cp,liquid | 389.27 | J/mol×K | 408.15 | Isobari... |
| Cp,liquid | 391.77 | J/mol×K | 413.15 | Isobari... |
| Cp,liquid | 394.27 | J/mol×K | 418.15 | Isobari... |
| Cp,liquid | 396.77 | J/mol×K | 423.15 | Isobari... |
| η | [0.0002633; 0.0041233] | Pa×s | [262.26; 494.36] |
|
|
T(K) Dynamic viscosity (Pa×s) 0 1.00e-3 2.00e-3 3.00e-3 4.00e-3 300 350 400 450 | ||||
| η | 0.0041233 | Pa×s | 262.26 | Joback Calculated Property |
| η | 0.0019414 | Pa×s | 300.94 | Joback Calculated Property |
| η | 0.0010852 | Pa×s | 339.63 | Joback Calculated Property |
| η | 0.0006832 | Pa×s | 378.31 | Joback Calculated Property |
| η | 0.0004687 | Pa×s | 416.99 | Joback Calculated Property |
| η | 0.0003428 | Pa×s | 455.68 | Joback Calculated Property |
| η | 0.0002633 | Pa×s | 494.36 | Joback Calculated Property |
| ΔvapH | [56.10; 56.60] | kJ/mol | [468.00; 476.50] |
|
| ΔvapH | 56.10 | kJ/mol | 468.00 | NIST |
| ΔvapH | 56.60 | kJ/mol | 476.50 | NIST |
| csound,fluid | [833.21; 1123.81] | m/s | [323.20; 423.27] |
|
|
T(K) Speed of sound in fluid (m/s) 850 900 950 1000 1050 1100 1150 350 400 | ||||
| csound,fluid | 1123.81 | m/s | 323.20 | Speed o... |
| csound,fluid | 1032.24 | m/s | 353.19 | Speed o... |
| csound,fluid | 944.49 | m/s | 383.22 | Speed o... |
| csound,fluid | 888.22 | m/s | 403.23 | Speed o... |
| csound,fluid | 833.21 | m/s | 423.27 | Speed o... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 377.25 ± 0.25 | K | 1.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.66] | kPa | [391.00; 539.76] |
The Yaw...
|
| Equation | ln(Pvp) = A + B/(T + C) | |||
| Coefficient A | 1.56804e+01 | |||
| Coefficient B | -4.72600e+03 | |||
| Coefficient C | -8.39720e+01 | |||
| Temperature range, min. | 391.00 | |||
| Temperature range, max. | 539.76 | |||
|
T(K) Vapor pressure (kPa) 0 50 100 150 200 400 450 500 | ||||
| Pvap | 1.33 | kPa | 391.00 | Calculated Property |
| Pvap | 2.93 | kPa | 407.53 | Calculated Property |
| Pvap | 5.95 | kPa | 424.06 | Calculated Property |
| Pvap | 11.34 | kPa | 440.59 | Calculated Property |
| Pvap | 20.39 | kPa | 457.12 | Calculated Property |
| Pvap | 34.89 | kPa | 473.64 | Calculated Property |
| Pvap | 57.15 | kPa | 490.17 | Calculated Property |
| Pvap | 90.08 | kPa | 506.70 | Calculated Property |
| Pvap | 137.19 | kPa | 523.23 | Calculated Property |
| Pvap | 202.66 | kPa | 539.76 | Calculated Property |
| Pvap | [1.35; 321.17] | kPa | [383.15; 570.15] |
KDB Vap...
|
| Equation | ln(Pvp) = A + B/T + C*ln(T) + D*T^2 | |||
| Coefficient A | 1.06974e+02 | |||
| Coefficient B | -1.13131e+04 | |||
| Coefficient C | -1.31064e+01 | |||
| Coefficient D | 5.57428e-06 | |||
| Temperature range, min. | 383.15 | |||
| Temperature range, max. | 570.15 | |||
|
T(K) Vapor pressure (kPa) 0 50 100 150 200 250 300 350 400 450 500 550 | ||||
| Pvap | 1.35 | kPa | 383.15 | Calculated Property |
| Pvap | 3.39 | kPa | 403.93 | Calculated Property |
| Pvap | 7.61 | kPa | 424.71 | Calculated Property |
| Pvap | 15.60 | kPa | 445.48 | Calculated Property |
| Pvap | 29.58 | kPa | 466.26 | Calculated Property |
| Pvap | 52.52 | kPa | 487.04 | Calculated Property |
| Pvap | 88.17 | kPa | 507.82 | Calculated Property |
| Pvap | 141.09 | kPa | 528.59 | Calculated Property |
| Pvap | 216.67 | kPa | 549.37 | Calculated Property |
| Pvap | 321.17 | kPa | 570.15 | Calculated Property |
Similar Compounds
Find more compounds similar to Decane, 1-bromo-.
Sources
- KDB Vapor Pressure Data
- Crippen Method
- Crippen Method
- Isobaric heat capacity, isothermal compressibility and fluctuational properties of 1- bromoalkanes
- Heat Capacities of 1-chloroalkanes and 1-bromoalkanes within the temperature range from 284.15 K to 353.15 K. A group additivity and molecular connectivity analysis
- Speed of Sound, Densities, and Isentropic Compressibilities of Liquid 1-Bromoalkanes at Temperatures from (243.15 to 423.15) K
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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