- InChI
- InChI=1S/C7H14O2/c1-7(9)5-3-2-4-6(7)8/h6,8-9H,2-5H2,1H3/t6-,7-/m1/s1
- InChI Key
- IOZFUGDROBQPNP-RNFRBKRXSA-N
- Formula
- C7H14O2
- SMILES
- CC1(O)CCCCC1O
- Molecular Weight1
- 130.18
- CAS
- 19534-08-8
- Other Names
-
- trans-1-Methyl-1,2-Cyclohexanediol
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- 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 |
|---|---|---|---|
| ΔcH°solid | -4157.00 ± 0.40 | kJ/mol | NIST |
| ΔfG° | -254.33 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -443.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.50 | kJ/mol | Joback Calculated Property |
| log10WS | -1.40 | Crippen Calculated Property | |
| logPoct/wat | 0.672 | Crippen Calculated Property | |
| McVol | 110.370 | ml/mol | McGowan Calculated Property |
| Pc | 4510.35 | kPa | Joback Calculated Property |
| Tboil | 559.04 | K | Joback Calculated Property |
| Tc | 748.16 | K | Joback Calculated Property |
| Tfus | 317.33 | K | Joback Calculated Property |
| Vc | 0.396 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [285.80; 347.72] | J/mol×K | [559.04; 748.16] | 
|
| Cp,gas | 285.80 | J/mol×K | 559.04 | Joback Calculated Property |
| Cp,gas | 297.47 | J/mol×K | 590.56 | Joback Calculated Property |
| Cp,gas | 308.51 | J/mol×K | 622.08 | Joback Calculated Property |
| Cp,gas | 318.98 | J/mol×K | 653.60 | Joback Calculated Property |
| Cp,gas | 328.96 | J/mol×K | 685.12 | Joback Calculated Property |
| Cp,gas | 338.52 | J/mol×K | 716.64 | Joback Calculated Property |
| Cp,gas | 347.72 | J/mol×K | 748.16 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanediol, 1-methyl-, trans-.
Sources
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