- InChI
- InChI=1S/C16H14O2/c17-15-11-7-1-2-8(5-7)12(11)16(18)14-10-4-3-9(6-10)13(14)15/h1-4,7-10,17-18H,5-6H2
- InChI Key
- RBOSFZNDAGQKRM-UHFFFAOYSA-N
- Formula
- C16H14O2
- SMILES
-
Oc1c2c(c(O)c3c1C1C=CC3C1)C1C=C
C2C1 - Molecular Weight1
- 238.28
- CAS
- 17694-16-5
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- 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 | 0.6491 | Relay (1.0) Calculated Property | |
| ΔfG° | 185.24 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -74.55 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.82 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 131.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 7.29 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.55 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.379 | Crippen Calculated Property | |
| McVol | 172.240 | ml/mol | McGowan Calculated Property |
| Pc | 3773.04 | kPa | Joback Calculated Property |
| Tboil | 581.91 | K | Relay (1.0) Calculated Property |
| Tc | 946.66 | K | Relay (1.0) Calculated Property |
| Tfus | 517.49 | K | Relay (1.0) Calculated Property |
| Vc | 0.681 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [541.75; 630.87] | J/mol×K | [785.08; 1038.81] | 
|
| Cp,gas | 541.75 | J/mol×K | 785.08 | Joback Calculated Property |
| Cp,gas | 555.29 | J/mol×K | 827.37 | Joback Calculated Property |
| Cp,gas | 568.83 | J/mol×K | 869.66 | Joback Calculated Property |
| Cp,gas | 582.77 | J/mol×K | 911.95 | Joback Calculated Property |
| Cp,gas | 597.50 | J/mol×K | 954.23 | Joback Calculated Property |
| Cp,gas | 613.40 | J/mol×K | 996.52 | Joback Calculated Property |
| Cp,gas | 630.87 | J/mol×K | 1038.81 | Joback Calculated Property |
| η | [0.0001075; 0.0003528] | Pa×s | [637.82; 785.08] |
|
| η | 0.0003528 | Pa×s | 637.82 | Joback Calculated Property |
| η | 0.0002790 | Pa×s | 662.36 | Joback Calculated Property |
| η | 0.0002244 | Pa×s | 686.91 | Joback Calculated Property |
| η | 0.0001832 | Pa×s | 711.45 | Joback Calculated Property |
| η | 0.0001516 | Pa×s | 735.99 | Joback Calculated Property |
| η | 0.0001269 | Pa×s | 760.54 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 785.08 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,4,5,8-Dimethanoanthracene-9,10-diol-1,4,5,8-tetrahydro.
Sources
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