- InChI
- InChI=1S/C6H14/c1-3-5-6-4-2/h3-6H2,1-2H3/i1D3,3D2,5D2
- InChI Key
- VLKZOEOYAKHREP-HJHJEWFGSA-N
- Formula
- C6H7D7
- SMILES
- CCCCCC
- Molecular Weight1
- 93.22
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -0.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -167.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.30 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 28.95 | kJ/mol | Joback Calculated Property |
| log10WS | -2.33 | Crippen Calculated Property | |
| logPoct/wat | 2.587 | Crippen Calculated Property | |
| McVol | 95.400 | ml/mol | McGowan Calculated Property |
| Pc | 3107.10 | kPa | Joback Calculated Property |
| Inp | [595.00; 595.00] |
|
|
| Inp | 595.00 | NIST | |
| Inp | 595.00 | NIST | |
| Tboil | 336.68 | K | Joback Calculated Property |
| Tc | 499.98 | K | Joback Calculated Property |
| Tfus | 157.38 | K | Joback Calculated Property |
| Vc | 0.371 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [158.63; 216.22] | J/mol×K | [336.68; 499.98] |
|
| Cp,gas | 158.63 | J/mol×K | 336.68 | Joback Calculated Property |
| Cp,gas | 169.08 | J/mol×K | 363.90 | Joback Calculated Property |
| Cp,gas | 179.18 | J/mol×K | 391.11 | Joback Calculated Property |
| Cp,gas | 188.94 | J/mol×K | 418.33 | Joback Calculated Property |
| Cp,gas | 198.36 | J/mol×K | 445.54 | Joback Calculated Property |
| Cp,gas | 207.45 | J/mol×K | 472.76 | Joback Calculated Property |
| Cp,gas | 216.22 | J/mol×K | 499.98 | Joback Calculated Property |
| η | [0.0002295; 0.0044393] | Pa×s | [157.38; 336.68] |
|
| η | 0.0044393 | Pa×s | 157.38 | Joback Calculated Property |
| η | 0.0018274 | Pa×s | 187.26 | Joback Calculated Property |
| η | 0.0009604 | Pa×s | 217.15 | Joback Calculated Property |
| η | 0.0005897 | Pa×s | 247.03 | Joback Calculated Property |
| η | 0.0004023 | Pa×s | 276.91 | Joback Calculated Property |
| η | 0.0002957 | Pa×s | 306.80 | Joback Calculated Property |
| η | 0.0002295 | Pa×s | 336.68 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexane-d7.
Sources
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