- InChI
- InChI=1S/C16H18/c1-14(16-10-6-3-7-11-16)12-13-15-8-4-2-5-9-15/h2-11,14H,12-13H2,1H3/t14-/m1/s1
- InChI Key
- PDINXYLAVFUHSA-CQSZACIVSA-N
- Formula
- C16H18
- SMILES
- CC(CCc1ccccc1)c1ccccc1
- Molecular Weight1
- 210.31
- CAS
- 17293-55-9
- 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).
- 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 | 0.4588 | Relay (1.0) Calculated Property | |
| ΔfG° | 306.22 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 112.41 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 21.76 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.17 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.45 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.13 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.423 | Crippen Calculated Property | |
| McVol | 188.780 | ml/mol | McGowan Calculated Property |
| Pc | 2302.53 | kPa | Joback Calculated Property |
| Tboil | 566.89 | K | Relay (1.0) Calculated Property |
| Tc | 803.75 | K | Relay (1.0) Calculated Property |
| Tfus | 256.85 | K | Relay (1.0) Calculated Property |
| Vc | 0.698 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [472.73; 568.06] | J/mol×K | [618.40; 853.40] | 
|
| Cp,gas | 472.73 | J/mol×K | 618.40 | Joback Calculated Property |
| Cp,gas | 491.86 | J/mol×K | 657.57 | Joback Calculated Property |
| Cp,gas | 509.59 | J/mol×K | 696.73 | Joback Calculated Property |
| Cp,gas | 525.99 | J/mol×K | 735.90 | Joback Calculated Property |
| Cp,gas | 541.15 | J/mol×K | 775.06 | Joback Calculated Property |
| Cp,gas | 555.14 | J/mol×K | 814.23 | Joback Calculated Property |
| Cp,gas | 568.06 | J/mol×K | 853.40 | Joback Calculated Property |
| η | [0.0001403; 0.0032193] | Pa×s | [307.92; 618.40] |
|
| η | 0.0032193 | Pa×s | 307.92 | Joback Calculated Property |
| η | 0.0013116 | Pa×s | 359.67 | Joback Calculated Property |
| η | 0.0006698 | Pa×s | 411.41 | Joback Calculated Property |
| η | 0.0003975 | Pa×s | 463.16 | Joback Calculated Property |
| η | 0.0002620 | Pa×s | 514.91 | Joback Calculated Property |
| η | 0.0001863 | Pa×s | 566.65 | Joback Calculated Property |
| η | 0.0001403 | Pa×s | 618.40 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to C16H18.
Sources
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