- InChI
- InChI=1S/C10H14/c1-3-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/t9-/m0/s1
- InChI Key
- ZJMWRROPUADPEA-SECBINFHSA-N
- Formula
- C10H14
- SMILES
- CC[C@H](C)c1ccccc1
- Molecular Weight1
- 134.22
- 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).
- 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 |
|---|---|---|---|
| ω | 0.2992 | Relay (1.0) Calculated Property | |
| ΔfG° | 143.29 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -38.28 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 48.42 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.81 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.74 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.200 | Crippen Calculated Property | |
| McVol | 128.000 | ml/mol | McGowan Calculated Property |
| Pc | 2956.90 | kPa | Joback Calculated Property |
| Tboil | 450.85 | K | Relay (1.0) Calculated Property |
| Tc | 653.71 | K | Relay (1.0) Calculated Property |
| Tfus | 238.08 | K | Relay (1.0) Calculated Property |
| Vc | 0.471 | m3/kmol | Relay (1.0) Calculated Property |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 336.20 | K | 2.00 | NIST |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [160.05; 417.25] | 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 | -4.17890e+01 | |||
| Coefficient B | 8.80840e-01 | |||
| Coefficient C | -5.54600e-04 | |||
| Coefficient D | 1.32800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 160.05 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 206.30 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 247.15 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 283.03 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 314.34 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 341.52 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 364.98 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 385.14 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 402.43 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 417.25 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0057217; 0.0002026] | Pa×s | [213.88; 464.92] |
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 | -1.13505e+01 | |||
| Coefficient B | 1.32328e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 213.88 | |||
| Temperature range, max. | 464.92 | |||
| η | 0.0057217 | Pa×s | 213.88 | Calculated Property |
| η | 0.0028024 | Pa×s | 241.77 | Calculated Property |
| η | 0.0015910 | Pa×s | 269.67 | Calculated Property |
| η | 0.0010044 | Pa×s | 297.56 | Calculated Property |
| η | 0.0006861 | Pa×s | 325.45 | Calculated Property |
| η | 0.0004977 | Pa×s | 353.34 | Calculated Property |
| η | 0.0003784 | Pa×s | 381.24 | Calculated Property |
| η | 0.0002987 | Pa×s | 409.13 | Calculated Property |
| η | 0.0002430 | Pa×s | 437.02 | Calculated Property |
| η | 0.0002026 | Pa×s | 464.92 | Calculated Property |
Similar Compounds
Find more compounds similar to Benzene, (1-methylpropyl)-, (S)-.
Sources
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