![(+/-) - [1S-(1«beta»,4«beta»,4a«beta»,6«alpha»,8a«alpha»)]-1,6-Dimethyl-4-(1-methylethyl)-1,2, 3,4,4a,5,6,7,8,8a-decahydro-1,6-naphthalenediol](/cid/54-500-6/1S-1-beta-4-beta-4a-beta-6-alpha-8a-alpha-1-6-Dimethyl-4-1-methylethyl-1-2-3-4-4a-5-6-7-8-8a-decahydro-1-6-naphthalenediol.png "(+/-) - [1S-(1«beta»,4«beta»,4a«beta»,6«alpha»,8a«alpha»)]-1,6-Dimethyl-4-(1-methylethyl)-1,2, 3,4,4a,5,6,7,8,8a-decahydro-1,6-naphthalenediol")
- InChI
- InChI=1S/C15H28O2/c1-10(2)11-5-8-15(4,17)13-6-7-14(3,16)9-12(11)13/h10-13,16-17H,5-9H2,1-4H3/t11-,12-,13+,14+,15-/m0/s1
- InChI Key
- PNPPFTXWBZJPGW-AHDPXTMNSA-N
- Formula
- C15H28O2
- SMILES
-
CC(C)C1CCC(C)(O)C2CCC(C)(O)CC1
2 - Molecular Weight1
- 240.38
- 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).
- 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 | 0.6664 | Relay (... Calculated Property | |
| ΔfG° | -161.67 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -538.07 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 17.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 106.66 | kJ/mol | Relay (... Calculated Property |
| IE | 8.98 | eV | Relay (... Calculated Property |
| log10WS | -3.39 | Relay (... Calculated Property | |
| logPoct/wat | 2.971 | Crippen Calculated Property | |
| McVol | 212.230 | ml/mol | McGowan Calculated Property |
| Pc | 2235.52 | kPa | Joback Calculated Property |
| Inp | 1740.00 | NIST | |
| Tboil | 575.71 | K | Relay (... Calculated Property |
| Tc | 812.54 | K | Relay (... Calculated Property |
| Tfus | 360.16 | K | Relay (... Calculated Property |
| Vc | 0.765 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [691.30; 799.70] | J/mol×K | [743.55; 942.30] | 
|
| Cp,gas | 691.30 | J/mol×K | 743.55 | Joback Calculated Property |
| Cp,gas | 709.90 | J/mol×K | 776.67 | Joback Calculated Property |
| Cp,gas | 728.06 | J/mol×K | 809.80 | Joback Calculated Property |
| Cp,gas | 745.95 | J/mol×K | 842.92 | Joback Calculated Property |
| Cp,gas | 763.74 | J/mol×K | 876.05 | Joback Calculated Property |
| Cp,gas | 781.60 | J/mol×K | 909.17 | Joback Calculated Property |
| Cp,gas | 799.70 | J/mol×K | 942.30 | Joback Calculated Property |
Similar Compounds
Sources
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