- InChI
- InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h3-7H,2H2,1H3/i1D3,2D2,3D,4D,5D,6D,7D
- InChI Key
- YNQLUTRBYVCPMQ-CFTAVCBPSA-N
- Formula
- C8D10
- SMILES
- CCc1ccccc1
- Molecular Weight1
- 116.23
- CAS
- 25837-05-2
- Other Names
-
- Benzene-d5-, ethyl-d5-
- (2H10)ethylbenzene
- 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).
- Inp : Non-polar retention indices.
- I : 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 | 0.2942 | Relay (1.0) Calculated Property | |
| ΔfG° | 128.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 40.60 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 10.52 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.63 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.80 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.249 | Crippen Calculated Property | |
| McVol | 99.820 | ml/mol | McGowan Calculated Property |
| Pc | 3650.93 | kPa | Joback Calculated Property |
| Inp | 852.00 | NIST | |
| I | [1105.00; 1124.00] |
|
|
| I | 1124.00 | NIST | |
| I | 1105.00 | NIST | |
| I | 1105.00 | NIST | |
| Tboil | 408.13 | K | Relay (1.0) Calculated Property |
| Tc | 612.16 | K | Relay (1.0) Calculated Property |
| Tfus | 182.49 | K | Relay (1.0) Calculated Property |
| Vc | 0.372 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [175.34; 241.94] | J/mol×K | [409.12; 618.55] |
|
| Cp,gas | 175.34 | J/mol×K | 409.12 | Joback Calculated Property |
| Cp,gas | 188.16 | J/mol×K | 444.03 | Joback Calculated Property |
| Cp,gas | 200.25 | J/mol×K | 478.93 | Joback Calculated Property |
| Cp,gas | 211.64 | J/mol×K | 513.84 | Joback Calculated Property |
| Cp,gas | 222.37 | J/mol×K | 548.74 | Joback Calculated Property |
| Cp,gas | 232.46 | J/mol×K | 583.65 | Joback Calculated Property |
| Cp,gas | 241.94 | J/mol×K | 618.55 | Joback Calculated Property |
| η | [0.0002314; 0.0032282] | Pa×s | [206.34; 409.12] |
|
| η | 0.0032282 | Pa×s | 206.34 | Joback Calculated Property |
| η | 0.0015274 | Pa×s | 240.14 | Joback Calculated Property |
| η | 0.0008693 | Pa×s | 273.93 | Joback Calculated Property |
| η | 0.0005599 | Pa×s | 307.73 | Joback Calculated Property |
| η | 0.0003935 | Pa×s | 341.53 | Joback Calculated Property |
| η | 0.0002946 | Pa×s | 375.32 | Joback Calculated Property |
| η | 0.0002314 | Pa×s | 409.12 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethylbenzene-d10.
Sources
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