- InChI
- InChI=1S/C10H22O/c1-2-3-4-5-6-7-8-9-10-11/h11H,2-10H2,1H3
- InChI Key
- MWKFXSUHUHTGQN-UHFFFAOYSA-N
- Formula
- C10H22O
- SMILES
- CCCCCCCCCCO
- Molecular Weight1
- 158.28
- CAS
- 36729-58-5
- 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).
- 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 | 0.7822 | Relay (1.0) Calculated Property | |
| ΔfG° | -103.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -413.85 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 25.74 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.47 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.92 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.82 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.119 | Crippen Calculated Property | |
| McVol | 157.630 | ml/mol | McGowan Calculated Property |
| Pc | 2298.11 | kPa | Joback Calculated Property |
| Inp | [1244.00; 1289.00] |
|
|
| Inp | 1280.00 | NIST | |
| Inp | 1280.00 | NIST | |
| Inp | 1277.00 | NIST | |
| Inp | Outlier 1289.00 | NIST | |
| Inp | 1278.00 | NIST | |
| Inp | 1271.00 | NIST | |
| Inp | 1258.00 | NIST | |
| Inp | 1255.00 | NIST | |
| Inp | 1259.00 | NIST | |
| Inp | 1274.00 | NIST | |
| Inp | 1268.00 | NIST | |
| Inp | 1254.00 | NIST | |
| Inp | 1254.00 | NIST | |
| Inp | 1272.00 | NIST | |
| Inp | 1272.00 | NIST | |
| Inp | 1280.00 | NIST | |
| Inp | 1271.00 | NIST | |
| Inp | 1259.00 | NIST | |
| Inp | 1262.00 | NIST | |
| Inp | 1280.00 | NIST | |
| Inp | Outlier 1244.00 | NIST | |
| Inp | 1263.00 | NIST | |
| Inp | 1272.00 | NIST | |
| Inp | 1268.00 | NIST | |
| Inp | 1272.00 | NIST | |
| Inp | 1270.00 | NIST | |
| Inp | 1276.00 | NIST | |
| Inp | 1257.00 | NIST | |
| Inp | 1272.00 | NIST | |
| Inp | 1280.00 | NIST | |
| Inp | 1263.00 | NIST | |
| Inp | 1262.00 | NIST | |
| Inp | Outlier 1247.00 | NIST | |
| Inp | 1252.00 | NIST | |
| Inp | 1270.00 | NIST | |
| Inp | 1273.00 | NIST | |
| Inp | 1274.00 | NIST | |
| Inp | 1259.00 | NIST | |
| Inp | 1262.00 | NIST | |
| Inp | 1255.00 | NIST | |
| Inp | 1257.00 | NIST | |
| Inp | 1260.00 | NIST | |
| Inp | 1257.00 | NIST | |
| Inp | 1259.00 | NIST | |
| Inp | 1267.00 | NIST | |
| Inp | 1278.00 | NIST | |
| Inp | 1266.00 | NIST | |
| Inp | 1270.00 | NIST | |
| Inp | 1264.00 | NIST | |
| Inp | 1264.00 | NIST | |
| Inp | 1270.00 | NIST | |
| Inp | 1259.00 | NIST | |
| Inp | 1259.00 | NIST | |
| Inp | 1274.00 | NIST | |
| Inp | 1272.00 | NIST | |
| Inp | 1280.00 | NIST | |
| Inp | 1271.00 | NIST | |
| Inp | 1278.00 | NIST | |
| Inp | 1270.00 | NIST | |
| I | [1720.00; 1787.00] |
|
|
| I | 1756.70 | NIST | |
| I | 1764.20 | NIST | |
| I | 1764.40 | NIST | |
| I | 1782.40 | NIST | |
| I | 1755.20 | NIST | |
| I | 1763.10 | NIST | |
| I | 1770.90 | NIST | |
| I | 1784.90 | NIST | |
| I | 1764.00 | NIST | |
| I | 1765.00 | NIST | |
| I | 1746.00 | NIST | |
| I | 1740.00 | NIST | |
| I | 1769.00 | NIST | |
| I | 1764.00 | NIST | |
| I | 1736.00 | NIST | |
| I | 1764.00 | NIST | |
| I | 1745.00 | NIST | |
| I | 1736.00 | NIST | |
| I | 1779.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1767.00 | NIST | |
| I | Outlier 1720.00 | NIST | |
| I | 1764.00 | NIST | |
| I | Outlier 1720.00 | NIST | |
| I | 1787.00 | NIST | |
| I | 1747.00 | NIST | |
| I | 1755.00 | NIST | |
| I | 1755.00 | NIST | |
| I | 1773.00 | NIST | |
| I | 1758.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1769.00 | NIST | |
| I | 1729.00 | NIST | |
| I | 1730.00 | NIST | |
| I | 1730.00 | NIST | |
| I | 1765.00 | NIST | |
| I | 1740.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1735.00 | NIST | |
| I | 1736.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1766.00 | NIST | |
| I | Outlier 1720.00 | NIST | |
| I | 1766.00 | NIST | |
| I | 1764.00 | NIST | |
| I | 1755.00 | NIST | |
| I | 1729.00 | NIST | |
| Tboil | 509.48 | K | Relay (1.0) Calculated Property |
| Tc | 693.89 | K | Relay (1.0) Calculated Property |
| Tfus | 283.22 | K | Relay (1.0) Calculated Property |
| Vc | 0.615 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [380.70; 452.84] | J/mol×K | [520.58; 679.13] |
|
| Cp,gas | 380.70 | J/mol×K | 520.58 | Joback Calculated Property |
| Cp,gas | 393.93 | J/mol×K | 547.00 | Joback Calculated Property |
| Cp,gas | 406.66 | J/mol×K | 573.43 | Joback Calculated Property |
| Cp,gas | 418.90 | J/mol×K | 599.85 | Joback Calculated Property |
| Cp,gas | 430.67 | J/mol×K | 626.28 | Joback Calculated Property |
| Cp,gas | 441.98 | J/mol×K | 652.70 | Joback Calculated Property |
| Cp,gas | 452.84 | J/mol×K | 679.13 | Joback Calculated Property |
| η | [0.0001239; 0.0327895] | Pa×s | [263.28; 520.58] |
|
| η | 0.0327895 | Pa×s | 263.28 | Joback Calculated Property |
| η | 0.0067476 | Pa×s | 306.16 | Joback Calculated Property |
| η | 0.0020477 | Pa×s | 349.05 | Joback Calculated Property |
| η | 0.0008067 | Pa×s | 391.93 | Joback Calculated Property |
| η | 0.0003819 | Pa×s | 434.81 | Joback Calculated Property |
| η | 0.0002068 | Pa×s | 477.70 | Joback Calculated Property |
| η | 0.0001239 | Pa×s | 520.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Decanol.
Sources
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