- InChI
- InChI=1S/C9H20O/c1-3-9(2)7-5-4-6-8-10/h9-10H,3-8H2,1-2H3/t9-/m1/s1
- InChI Key
- WWRGKAMABZHMCN-SECBINFHSA-N
- Formula
- C9H20O
- SMILES
- CCC(C)CCCCCO
- Molecular Weight1
- 144.25
- CAS
- 110453-78-6
- Other Names
-
- d-6-methyl-1-octanol
- 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).
- 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° | -114.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -386.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.92 | kJ/mol | Joback Calculated Property |
| log10WS | -2.61 | Crippen Calculated Property | |
| logPoct/wat | 2.585 | Crippen Calculated Property | |
| McVol | 143.540 | ml/mol | McGowan Calculated Property |
| Pc | 2545.61 | kPa | Joback Calculated Property |
| Tboil | 497.06 | K | Joback Calculated Property |
| Tc | 659.14 | K | Joback Calculated Property |
| Tfus | 237.01 | K | Joback Calculated Property |
| Vc | 0.552 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [334.58; 403.87] | J/mol×K | [497.06; 659.14] | 
|
| Cp,gas | 334.58 | J/mol×K | 497.06 | Joback Calculated Property |
| Cp,gas | 347.30 | J/mol×K | 524.07 | Joback Calculated Property |
| Cp,gas | 359.54 | J/mol×K | 551.09 | Joback Calculated Property |
| Cp,gas | 371.30 | J/mol×K | 578.10 | Joback Calculated Property |
| Cp,gas | 382.60 | J/mol×K | 605.11 | Joback Calculated Property |
| Cp,gas | 393.45 | J/mol×K | 632.13 | Joback Calculated Property |
| Cp,gas | 403.87 | J/mol×K | 659.14 | Joback Calculated Property |
| η | [0.0001409; 0.0878509] | Pa×s | [237.01; 497.06] |
|
| η | 0.0878509 | Pa×s | 237.01 | Joback Calculated Property |
| η | 0.0131188 | Pa×s | 280.35 | Joback Calculated Property |
| η | 0.0032599 | Pa×s | 323.69 | Joback Calculated Property |
| η | 0.0011254 | Pa×s | 367.03 | Joback Calculated Property |
| η | 0.0004864 | Pa×s | 410.38 | Joback Calculated Property |
| η | 0.0002468 | Pa×s | 453.72 | Joback Calculated Property |
| η | 0.0001409 | Pa×s | 497.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (S)-(+)-6-Methyl-1-octanol.
Sources
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