- InChI
- InChI=1S/C9H11/c1-2-6-9-7-4-3-5-8-9/h3-8H,2H2,1H3
- InChI Key
- AKVBZJSJOOBLEB-UHFFFAOYSA-N
- Formula
- C9H11
- SMILES
- CC[CH]c1ccccc1
- Molecular Weight1
- 119.18
- CAS
- 19019-92-2
- PAff : Proton affinity (kJ/mol).
- BasG : Gas basicity (kJ/mol).
- 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).
- 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).
- 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 |
|---|---|---|---|
| PAff | 842.20 | kJ/mol | NIST |
| BasG | 809.70 | kJ/mol | NIST |
| ΔfG° | 187.25 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 57.97 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.27 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 37.37 | kJ/mol | Joback Calculated Property |
| log10WS | -2.41 | Crippen Calculated Property | |
| logPoct/wat | 2.649 | Crippen Calculated Property | |
| McVol | 111.760 | ml/mol | McGowan Calculated Property |
| Pc | 3464.28 | kPa | Joback Calculated Property |
| Tboil | 430.86 | K | Joback Calculated Property |
| Tc | 639.19 | K | Joback Calculated Property |
| Tfus | 218.98 | K | Joback Calculated Property |
| Vc | 0.416 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [208.71; 277.73] | J/mol×K | [430.86; 639.19] | 
|
| Cp,gas | 208.71 | J/mol×K | 430.86 | Joback Calculated Property |
| Cp,gas | 222.35 | J/mol×K | 465.58 | Joback Calculated Property |
| Cp,gas | 235.07 | J/mol×K | 500.30 | Joback Calculated Property |
| Cp,gas | 246.90 | J/mol×K | 535.02 | Joback Calculated Property |
| Cp,gas | 257.92 | J/mol×K | 569.75 | Joback Calculated Property |
| Cp,gas | 268.18 | J/mol×K | 604.47 | Joback Calculated Property |
| Cp,gas | 277.73 | J/mol×K | 639.19 | Joback Calculated Property |
| η | [0.0003521; 0.0020068] | Pa×s | [218.98; 430.86] |
|
| η | 0.0020068 | Pa×s | 218.98 | Joback Calculated Property |
| η | 0.0012276 | Pa×s | 254.29 | Joback Calculated Property |
| η | 0.0008466 | Pa×s | 289.61 | Joback Calculated Property |
| η | 0.0006329 | Pa×s | 324.92 | Joback Calculated Property |
| η | 0.0005010 | Pa×s | 360.23 | Joback Calculated Property |
| η | 0.0004134 | Pa×s | 395.55 | Joback Calculated Property |
| η | 0.0003521 | Pa×s | 430.86 | Joback Calculated Property |
Similar Compounds
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Sources
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