- InChI
- InChI=1S/C15H24/c1-2-3-4-5-6-7-9-12-15-13-10-8-11-14-15/h8,10-11,13-14H,2-7,9,12H2,1H3
- InChI Key
- LIXVMPBOGDCSRM-UHFFFAOYSA-N
- Formula
- C15H24
- SMILES
- CCCCCCCCCc1ccccc1
- Molecular Weight1
- 204.35
- CAS
- 1081-77-2
- Other Names
-
- 1-Phenylnonane
- Nonane, 1-phenyl-
- Nonylbenzene
- n-Nonylbenzene
- 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).
- 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).
- NFPA Fire : NFPA Fire Rating.
- Pc : Critical Pressure (kPa).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- Ip : Polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- VCOSTALD : COSTALD Characteristic Volume (m3/kmol).
- ωSRK : SRK acentric factor.
- Zc : Critical Compressibility.
- Zra : Rackett Parameter.
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | [0.6095; 0.6280] |
|
|
| ω | 0.6095 | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value | |
| ω | 0.6280 | KDB | |
| ΔfG° | 187.83 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -99.81 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 28.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | [74.10; 74.80] | kJ/mol |
|
| ΔvapH° | 74.10 ± 0.50 | kJ/mol | NIST |
| ΔvapH° | 74.80 | kJ/mol | NIST |
| IE | 8.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.21 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.980 | Crippen Calculated Property | |
| McVol | 198.450 | ml/mol | McGowan Calculated Property |
| NFPA Fire | 1 | KDB | |
| Pc | [1900.00; 1900.00] | kPa |
|
| Pc | 1900.00 | kPa | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Pc | 1900.00 | kPa | KDB |
| Inp | [265.51; 1586.00] |
|
|
| Inp | 1527.00 | NIST | |
| Inp | 1555.00 | NIST | |
| Inp | 1586.00 | NIST | |
| Inp | 1559.50 | NIST | |
| Inp | 1560.00 | NIST | |
| Inp | 1552.20 | NIST | |
| Inp | 1556.98 | NIST | |
| Inp | 1560.39 | NIST | |
| Inp | 1570.95 | NIST | |
| Inp | 1576.27 | NIST | |
| Inp | 1579.75 | NIST | |
| Inp | 1555.00 | NIST | |
| Inp | 1554.10 | NIST | |
| Inp | 1542.80 | NIST | |
| Inp | 1554.00 | NIST | |
| Inp | 1542.80 | NIST | |
| Inp | 1555.00 | NIST | |
| Inp | 1527.00 | NIST | |
| Inp | Outlier 265.60 | NIST | |
| Inp | Outlier 265.51 | NIST | |
| Inp | 1555.00 | NIST | |
| Inp | 1554.10 | NIST | |
| Inp | Outlier 265.60 | NIST | |
| Inp | 1527.00 | NIST | |
| Ip | [1821.00; 1854.00] |
|
|
| Ip | 1854.00 | NIST | |
| Ip | 1847.00 | NIST | |
| Ip | 1821.00 | NIST | |
| Ip | 1854.00 | NIST | |
| Tboil | [543.00; 555.20] | K |
|
| Tboil | 555.20 | K | KDB |
| Tboil | 555.20 | K | NIST |
| Tboil | 551.50 ± 1.50 | K | NIST |
| Tboil | Outlier 543.00 ± 5.00 | K | NIST |
| Tboil | 555.10 ± 0.60 | K | NIST |
| Tboil | 554.00 ± 3.00 | K | NIST |
| Tboil | 554.00 ± 3.00 | K | NIST |
| Tboil | 554.00 ± 3.00 | K | NIST |
| Tboil | 554.00 ± 3.00 | K | NIST |
| Tboil | 548.00 ± 3.00 | K | NIST |
| Tc | [741.00; 741.00] | K |
|
| Tc | 741.00 | K | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Tc | 741.00 | K | KDB |
| Tfus | [249.00; 249.15] | K |
|
| Tfus | 249.15 | K | Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) Compiled value |
| Tfus | 249.00 | K | KDB |
| Vc | [0.790; 0.790] | m3/kmol |
|
| Vc | 0.790 | m3/kmol | PSRK revision IV (2005), critical constants and acentric factors of 1000 components Compiled value |
| Vc | 0.790 | m3/kmol | KDB |
| VCOSTALD | 0.84 | m3/kmol | Hankinson and Thomson (1979), COSTALD parameters Compiled value |
| ωSRK | 0.66 | Hankinson and Thomson (1979), COSTALD parameters Compiled value | |
| Zc | 0.2436270 | KDB | |
| Zra | 0.25 | Hankinson and Thomson (1979), COSTALD parameters Compiled value |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| ΔvapH | [48.95; 69.70] | kJ/mol | [365.50; 555.20] |
|
| ΔvapH | 69.70 | kJ/mol | 365.50 | NIST |
| ΔvapH | 48.95 | kJ/mol | 555.20 | KDB |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [266.43; 674.67] | 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 | -4.46520e+01 | |||
| Coefficient B | 1.34992e+00 | |||
| Coefficient C | -8.23400e-04 | |||
| Coefficient D | 1.92800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 266.43 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 338.40 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 402.29 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 458.72 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 508.30 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 551.62 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 589.31 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 621.98 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 650.23 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 674.67 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0087386; 0.0002237] | Pa×s | [249.07; 518.70] |
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 | -1.17911e+01 | |||
| Coefficient B | 1.75626e+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. | 249.07 | |||
| Temperature range, max. | 518.70 | |||
| η | 0.0087386 | Pa×s | 249.07 | Calculated Property |
| η | 0.0040989 | Pa×s | 279.03 | Calculated Property |
| η | 0.0022266 | Pa×s | 308.99 | Calculated Property |
| η | 0.0013473 | Pa×s | 338.95 | Calculated Property |
| η | 0.0008845 | Pa×s | 368.91 | Calculated Property |
| η | 0.0006186 | Pa×s | 398.87 | Calculated Property |
| η | 0.0004548 | Pa×s | 428.82 | Calculated Property |
| η | 0.0003481 | Pa×s | 458.78 | Calculated Property |
| η | 0.0002753 | Pa×s | 488.74 | Calculated Property |
| η | 0.0002237 | Pa×s | 518.70 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Pvap | [1.33; 202.67] | kPa | [414.31; 584.98] |
The Yaws Handbook of Vapor Pressure
|
| Equation | ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.54330e+01 | |||
| Coefficient B | -5.20756e+03 | |||
| Coefficient C | -7.04730e+01 | |||
| Temperature range, min. | 414.31 | |||
| Temperature range, max. | 584.98 | |||
| Pvap | 1.33 | kPa | 414.31 | Calculated Property |
| Pvap | 2.94 | kPa | 433.27 | Calculated Property |
| Pvap | 6.00 | kPa | 452.24 | Calculated Property |
| Pvap | 11.45 | kPa | 471.20 | Calculated Property |
| Pvap | 20.59 | kPa | 490.16 | Calculated Property |
| Pvap | 35.21 | kPa | 509.13 | Calculated Property |
| Pvap | 57.59 | kPa | 528.09 | Calculated Property |
| Pvap | 90.57 | kPa | 547.05 | Calculated Property |
| Pvap | 137.58 | kPa | 566.02 | Calculated Property |
| Pvap | 202.67 | kPa | 584.98 | Calculated Property |
| Pvap | [1.30e-06; 1804.83] | kPa | [249.00; 741.00] |
KDB Vapor Pressure Data
|
| Equation | ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K | |||
| Coefficient A | 1.14515e+02 | |||
| Coefficient B | -1.27354e+04 | |||
| Coefficient C | -1.39957e+01 | |||
| Coefficient D | 4.83248e-06 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 249.00 | |||
| Temperature range, max. | 741.00 | |||
| Pvap | 1.30e-06 | kPa | 249.00 | Calculated Property |
| Pvap | 9.34e-04 | kPa | 303.67 | Calculated Property |
| Pvap | 0.07 | kPa | 358.33 | Calculated Property |
| Pvap | 1.22 | kPa | 413.00 | Calculated Property |
| Pvap | 9.96 | kPa | 467.67 | Calculated Property |
| Pvap | 47.59 | kPa | 522.33 | Calculated Property |
| Pvap | 159.15 | kPa | 577.00 | Calculated Property |
| Pvap | 416.73 | kPa | 631.67 | Calculated Property |
| Pvap | 920.41 | kPa | 686.33 | Calculated Property |
| Pvap | 1804.83 | kPa | 741.00 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, nonyl-.
Sources
- KDB Vapor Pressure Data
- 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).
- Hankinson and Thomson (1979), COSTALD parameters ChEDL chemicals 1.5.2, from Hankinson, R. W.; Thomson, G. H. A New Correlation for Saturated Densities of Liquids and Their Mixtures. AIChE J. 1979, 25, 653-663.
- 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
- Joback Method
- KDB
- McGowan Method
- NIST Webbook
- The Yaws Handbook of Vapor Pressure
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