- InChI
- InChI=1S/C15H14O2/c1-17-14(16)15(11-7-3-2-4-8-11)12-9-5-6-10-13(12)15/h2-10,12-13H,1H3
- InChI Key
- ZVIBIYYBAMLLDF-UHFFFAOYSA-N
- Formula
- C15H14O2
- SMILES
- COC(=O)C1(c2ccccc2)C2C=CC=CC21
- Molecular Weight1
- 226.27
- CAS
- 32777-09-6
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | 0.3617 | Relay (1.0) Calculated Property | |
| ΔfG° | 110.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -54.90 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.14 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.09 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.62 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.469 | Crippen Calculated Property | |
| McVol | 175.570 | ml/mol | McGowan Calculated Property |
| Pc | 2735.42 | kPa | Joback Calculated Property |
| Tboil | 535.84 | K | Relay (1.0) Calculated Property |
| Tc | 818.08 | K | Relay (1.0) Calculated Property |
| Tfus | 355.59 | K | Relay (1.0) Calculated Property |
| Vc | 0.602 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [472.74; 561.49] | J/mol×K | [657.21; 901.95] | 
|
| Cp,gas | 472.74 | J/mol×K | 657.21 | Joback Calculated Property |
| Cp,gas | 489.53 | J/mol×K | 698.00 | Joback Calculated Property |
| Cp,gas | 505.20 | J/mol×K | 738.79 | Joback Calculated Property |
| Cp,gas | 520.00 | J/mol×K | 779.58 | Joback Calculated Property |
| Cp,gas | 534.16 | J/mol×K | 820.37 | Joback Calculated Property |
| Cp,gas | 547.91 | J/mol×K | 861.16 | Joback Calculated Property |
| Cp,gas | 561.49 | J/mol×K | 901.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methyl 7-phenylnorcaradiene-7-carboxylate.
Sources
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