![(6R)-5,6-Dihydro-3,6-dimethyl-benzo-[b]-furan-2(4H)-one](/cid/85-857-7/6R-5-6-Dihydro-3-6-dimethyl-benzo-b-furan-2-4H-one.png "(6R)-5,6-Dihydro-3,6-dimethyl-benzo-[b]-furan-2(4H)-one")
- InChI
- InChI=1S/C10H12O2/c1-6-3-4-8-7(2)10(11)12-9(8)5-6/h5-6H,3-4H2,1-2H3/t6-/m0/s1
- InChI Key
- ZRTWVYJNKXXDDT-LURJTMIESA-N
- Formula
- C10H12O2
- SMILES
- CC1=C2CCC(C)C=C2OC1=O
- Molecular Weight1
- 164.20
- 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).
- I : 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 | 0.3931 | Relay (1.0) Calculated Property | |
| ΔfG° | -51.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -273.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.32 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 59.95 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.47 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.78 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.173 | Crippen Calculated Property | |
| McVol | 128.880 | ml/mol | McGowan Calculated Property |
| Pc | 3239.34 | kPa | Joback Calculated Property |
| I | [2323.00; 2323.00] |
|
|
| I | 2323.00 | NIST | |
| I | 2323.00 | NIST | |
| Tboil | 515.77 | K | Relay (1.0) Calculated Property |
| Tc | 745.49 | K | Relay (1.0) Calculated Property |
| Tfus | 342.94 | K | Relay (1.0) Calculated Property |
| Vc | 0.455 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [317.34; 396.39] | J/mol×K | [567.19; 803.33] |
|
| Cp,gas | 317.34 | J/mol×K | 567.19 | Joback Calculated Property |
| Cp,gas | 332.68 | J/mol×K | 606.55 | Joback Calculated Property |
| Cp,gas | 347.13 | J/mol×K | 645.90 | Joback Calculated Property |
| Cp,gas | 360.70 | J/mol×K | 685.26 | Joback Calculated Property |
| Cp,gas | 373.43 | J/mol×K | 724.62 | Joback Calculated Property |
| Cp,gas | 385.32 | J/mol×K | 763.97 | Joback Calculated Property |
| Cp,gas | 396.39 | J/mol×K | 803.33 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (6R)-5,6-Dihydro-3,6-dimethyl-benzo-[b]-furan-2(4H)-one.
Sources
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