- InChI
- InChI=1S/C11H16O/c1-3-4-7-10-8-5-6-9-11(10)12-2/h5-6,8-9H,3-4,7H2,1-2H3
- InChI Key
- ASJCVVGLGXVRGQ-UHFFFAOYSA-N
- Formula
- C11H16O
- SMILES
- CCCCc1ccccc1OC
- Molecular Weight1
- 164.25
- 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).
- Inp : Non-polar retention indices.
- 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 |
|---|---|---|---|
| ω | 0.5002 | Relay (1.0) Calculated Property | |
| ΔfG° | 39.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -161.47 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.09 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 61.71 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.09 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.56 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.038 | Crippen Calculated Property | |
| McVol | 147.960 | ml/mol | McGowan Calculated Property |
| Pc | 2563.69 | kPa | Joback Calculated Property |
| Inp | [1165.00; 1187.00] |
|
|
| Inp | 1165.00 | NIST | |
| Inp | 1187.00 | NIST | |
| Tboil | 496.41 | K | Relay (1.0) Calculated Property |
| Tc | 698.22 | K | Relay (1.0) Calculated Property |
| Tfus | 246.17 | K | Relay (1.0) Calculated Property |
| Vc | 0.546 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [326.15; 407.12] | J/mol×K | [505.36; 707.00] |
|
| Cp,gas | 326.15 | J/mol×K | 505.36 | Joback Calculated Property |
| Cp,gas | 341.41 | J/mol×K | 538.97 | Joback Calculated Property |
| Cp,gas | 355.95 | J/mol×K | 572.57 | Joback Calculated Property |
| Cp,gas | 369.77 | J/mol×K | 606.18 | Joback Calculated Property |
| Cp,gas | 382.90 | J/mol×K | 639.79 | Joback Calculated Property |
| Cp,gas | 395.34 | J/mol×K | 673.40 | Joback Calculated Property |
| Cp,gas | 407.12 | J/mol×K | 707.00 | Joback Calculated Property |
| η | [0.0001777; 0.0019708] | Pa×s | [274.90; 505.36] |
|
| η | 0.0019708 | Pa×s | 274.90 | Joback Calculated Property |
| η | 0.0010321 | Pa×s | 313.31 | Joback Calculated Property |
| η | 0.0006225 | Pa×s | 351.72 | Joback Calculated Property |
| η | 0.0004148 | Pa×s | 390.13 | Joback Calculated Property |
| η | 0.0002972 | Pa×s | 428.54 | Joback Calculated Property |
| η | 0.0002250 | Pa×s | 466.95 | Joback Calculated Property |
| η | 0.0001777 | Pa×s | 505.36 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Anisole, 2-butyl.
Sources
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