- InChI
- InChI=1S/C10H12O2/c11-9-5-7-3-1-2-4-8(7)6-10(9)12/h1-4,9-12H,5-6H2/t9-,10-/m0/s1
- InChI Key
- DHTGPMXCRKCPTP-UWVGGRQHSA-N
- Formula
- C10H12O2
- SMILES
- OC1Cc2ccccc2CC1O
- Molecular Weight1
- 164.20
- CAS
- 41597-55-1
- Other Names
-
- 1,2,3,4-Tetrahydro-2,3-naphthalenediol, trans-
- 2,3-Naphthalenediol, 1,2,3,4-tetrahydro-, trans-
- trans-1,2,3,4-Tetrahydro-2,3-naphthalenediol
- trans-Tetralin-2,3-diol
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 |
|---|---|---|---|
| ΔfH°gas | -244.91 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 20.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.16 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.75 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 0.507 | Crippen Calculated Property | |
| McVol | 128.880 | ml/mol | McGowan Calculated Property |
| Pc | 4130.29 | kPa | Joback Calculated Property |
| Inp | 1550.00 | NIST | |
| Tboil | 581.93 | K | Relay (1.0) Calculated Property |
| Tc | 810.78 | K | Relay (1.0) Calculated Property |
| Tfus | 415.55 | K | Relay (1.0) Calculated Property |
| Vc | 0.467 | m3/kmol | Relay (1.0) Calculated Property |
Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [350.56; 408.57] | J/mol×K | [650.76; 851.12] | 
|
| Cp,gas | 350.56 | J/mol×K | 650.76 | Joback Calculated Property |
| Cp,gas | 361.86 | J/mol×K | 684.15 | Joback Calculated Property |
| Cp,gas | 372.47 | J/mol×K | 717.55 | Joback Calculated Property |
| Cp,gas | 382.40 | J/mol×K | 750.94 | Joback Calculated Property |
| Cp,gas | 391.70 | J/mol×K | 784.33 | Joback Calculated Property |
| Cp,gas | 400.41 | J/mol×K | 817.73 | Joback Calculated Property |
| Cp,gas | 408.57 | J/mol×K | 851.12 | Joback Calculated Property |
| η | [0.0000474; 0.0052728] | Pa×s | [373.22; 650.76] |
|
| η | 0.0052728 | Pa×s | 373.22 | Joback Calculated Property |
| η | 0.0015594 | Pa×s | 419.48 | Joback Calculated Property |
| η | 0.0005875 | Pa×s | 465.73 | Joback Calculated Property |
| η | 0.0002640 | Pa×s | 511.99 | Joback Calculated Property |
| η | 0.0001355 | Pa×s | 558.25 | Joback Calculated Property |
| η | 0.0000770 | Pa×s | 604.50 | Joback Calculated Property |
| η | 0.0000474 | Pa×s | 650.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-Tetraline-2,3-diol.
Sources
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