- InChI
- InChI=1S/C15H22O/c1-11(2)15-9-8-14(10-15)12(3)6-5-7-13(14,4)16-15/h5,7,12H,1,6,8-10H2,2-4H3/t12-,13+,14-,15+/m0/s1
- InChI Key
- RJDKCAMBNKUPIB-LJISPDSOSA-N
- Formula
- C15H22O
- SMILES
-
C=C(C)C12CCC3(C1)C(C)CC=CC3(C)
O2 - Molecular Weight1
- 218.33
- Other Names
-
- 4,7-epoxy-spirovetiva-2,11-diene
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 232.42 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -80.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 13.60 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 49.52 | kJ/mol | Joback Calculated Property |
| log10WS | -4.32 | Crippen Calculated Property | |
| logPoct/wat | 3.857 | Crippen Calculated Property | |
| McVol | 186.900 | ml/mol | McGowan Calculated Property |
| Pc | 2398.22 | kPa | Joback Calculated Property |
| Inp | 1478.00 | NIST | |
| Tboil | 590.08 | K | Joback Calculated Property |
| Tc | 830.63 | K | Joback Calculated Property |
| Tfus | 384.66 | K | Joback Calculated Property |
| Vc | 0.713 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [514.13; 628.69] | J/mol×K | [590.08; 830.63] | 
|
| Cp,gas | 514.13 | J/mol×K | 590.08 | Joback Calculated Property |
| Cp,gas | 535.34 | J/mol×K | 630.17 | Joback Calculated Property |
| Cp,gas | 555.05 | J/mol×K | 670.26 | Joback Calculated Property |
| Cp,gas | 573.73 | J/mol×K | 710.36 | Joback Calculated Property |
| Cp,gas | 591.90 | J/mol×K | 750.45 | Joback Calculated Property |
| Cp,gas | 610.06 | J/mol×K | 790.54 | Joback Calculated Property |
| Cp,gas | 628.69 | J/mol×K | 830.63 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4,7-Epoxi-spirovetiva-2,11-diene.
Sources
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