- InChI
- InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h5,10-11H,4,6-8H2,1-3H3/t10-/m0/s1
- InChI Key
- QMVPMAAFGQKVCJ-JTQLQIEISA-N
- Formula
- C10H20O
- SMILES
- CC(C)=CCCC(C)CCO
- Molecular Weight1
- 156.27
- CAS
- 1117-61-9
- Other Names
-
- (-)-beta-citronellol
- (-)-citronellol
- (R)-(+)-«beta»-Citronellol
- (R)-3,7-dimethyloct-6-en-1-ol
- (R)-citronellol
- (S)-(-)-B-citronellol
- (S)-(-)-citronellol
- (S)-3,7-dimethyl-6-octen-1-ol
- L-citronellol
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- Pvap : Vapor pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tboilr : Boiling point at reduced pressure (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° | -34.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -299.81 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 21.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 54.18 | kJ/mol | Joback Calculated Property |
| log10WS | -2.88 | Crippen Calculated Property | |
| logPoct/wat | 2.751 | Crippen Calculated Property | |
| McVol | 153.330 | ml/mol | McGowan Calculated Property |
| Pc | 2448.32 | kPa | Joback Calculated Property |
| Inp | [1220.00; 1220.00] |
|
|
| Inp | 1220.00 | NIST | |
| Inp | 1220.00 | NIST | |
| Tboil | 523.98 | K | Joback Calculated Property |
| Tc | 694.42 | K | Joback Calculated Property |
| Tfus | 229.24 | K | Joback Calculated Property |
| Vc | 0.590 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [362.91; 434.56] | J/mol×K | [523.98; 694.42] |
|
| Cp,gas | 362.91 | J/mol×K | 523.98 | Joback Calculated Property |
| Cp,gas | 376.24 | J/mol×K | 552.39 | Joback Calculated Property |
| Cp,gas | 388.99 | J/mol×K | 580.79 | Joback Calculated Property |
| Cp,gas | 401.17 | J/mol×K | 609.20 | Joback Calculated Property |
| Cp,gas | 412.81 | J/mol×K | 637.61 | Joback Calculated Property |
| Cp,gas | 423.93 | J/mol×K | 666.01 | Joback Calculated Property |
| Cp,gas | 434.56 | J/mol×K | 694.42 | Joback Calculated Property |
| Pvap | [1.29e-04; 0.46] | kPa | [273.65; 362.98] |
|
| Pvap | 1.29e-04 | kPa | 273.65 | Vapor p... |
| Pvap | 1.30e-04 | kPa | 273.65 | Vapor p... |
| Pvap | 1.33e-04 | kPa | 273.65 | Vapor p... |
| Pvap | 2.31e-04 | kPa | 278.15 | Vapor p... |
| Pvap | 2.28e-04 | kPa | 278.15 | Vapor p... |
| Pvap | 2.35e-04 | kPa | 278.15 | Vapor p... |
| Pvap | 4.30e-04 | kPa | 283.15 | Vapor p... |
| Pvap | 4.30e-04 | kPa | 283.15 | Vapor p... |
| Pvap | 4.32e-04 | kPa | 283.15 | Vapor p... |
| Pvap | 7.70e-04 | kPa | 288.15 | Vapor p... |
| Pvap | 7.79e-04 | kPa | 288.15 | Vapor p... |
| Pvap | 7.77e-04 | kPa | 288.15 | Vapor p... |
| Pvap | 1.36e-03 | kPa | 293.15 | Vapor p... |
| Pvap | 1.36e-03 | kPa | 293.15 | Vapor p... |
| Pvap | 1.36e-03 | kPa | 293.15 | Vapor p... |
| Pvap | 1.32e-03 | kPa | 293.17 | Vapor p... |
| Pvap | 1.33e-03 | kPa | 293.17 | Vapor p... |
| Pvap | 1.33e-03 | kPa | 293.17 | Vapor p... |
| Pvap | 2.32e-03 | kPa | 298.15 | Vapor p... |
| Pvap | 2.33e-03 | kPa | 298.15 | Vapor p... |
| Pvap | 2.33e-03 | kPa | 298.15 | Vapor p... |
| Pvap | 2.27e-03 | kPa | 298.18 | Vapor p... |
| Pvap | 2.27e-03 | kPa | 298.19 | Vapor p... |
| Pvap | 2.27e-03 | kPa | 298.20 | Vapor p... |
| Pvap | 3.87e-03 | kPa | 303.15 | Vapor p... |
| Pvap | 3.88e-03 | kPa | 303.15 | Vapor p... |
| Pvap | 3.87e-03 | kPa | 303.15 | Vapor p... |
| Pvap | 3.79e-03 | kPa | 303.16 | Vapor p... |
| Pvap | 3.81e-03 | kPa | 303.19 | Vapor p... |
| Pvap | 3.80e-03 | kPa | 303.20 | Vapor p... |
| Pvap | 6.30e-03 | kPa | 308.15 | Vapor p... |
| Pvap | 6.30e-03 | kPa | 308.15 | Vapor p... |
| Pvap | 6.28e-03 | kPa | 308.15 | Vapor p... |
| Pvap | 6.21e-03 | kPa | 308.19 | Vapor p... |
| Pvap | 6.20e-03 | kPa | 308.19 | Vapor p... |
| Pvap | 6.20e-03 | kPa | 308.21 | Vapor p... |
| Pvap | 9.90e-03 | kPa | 313.20 | Vapor p... |
| Pvap | 9.90e-03 | kPa | 313.21 | Vapor p... |
| Pvap | 9.91e-03 | kPa | 313.21 | Vapor p... |
| Pvap | 0.02 | kPa | 318.23 | Vapor p... |
| Pvap | 0.02 | kPa | 318.24 | Vapor p... |
| Pvap | 0.02 | kPa | 318.24 | Vapor p... |
| Pvap | 0.02 | kPa | 323.22 | Vapor p... |
| Pvap | 0.02 | kPa | 323.23 | Vapor p... |
| Pvap | 0.02 | kPa | 323.23 | Vapor p... |
| Pvap | 0.04 | kPa | 328.20 | Vapor p... |
| Pvap | 0.04 | kPa | 328.21 | Vapor p... |
| Pvap | 0.04 | kPa | 328.21 | Vapor p... |
| Pvap | 0.06 | kPa | 333.23 | Vapor p... |
| Pvap | 0.06 | kPa | 333.23 | Vapor p... |
| Pvap | 0.06 | kPa | 333.23 | Vapor p... |
| Pvap | 0.08 | kPa | 338.19 | Vapor p... |
| Pvap | 0.08 | kPa | 338.20 | Vapor p... |
| Pvap | 0.08 | kPa | 338.20 | Vapor p... |
| Pvap | 0.12 | kPa | 343.19 | Vapor p... |
| Pvap | 0.12 | kPa | 343.19 | Vapor p... |
| Pvap | 0.12 | kPa | 343.19 | Vapor p... |
| Pvap | 0.17 | kPa | 348.14 | Vapor p... |
| Pvap | 0.17 | kPa | 348.15 | Vapor p... |
| Pvap | 0.17 | kPa | 348.15 | Vapor p... |
| Pvap | 0.24 | kPa | 353.10 | Vapor p... |
| Pvap | 0.24 | kPa | 353.10 | Vapor p... |
| Pvap | 0.24 | kPa | 353.10 | Vapor p... |
| Pvap | 0.33 | kPa | 358.01 | Vapor p... |
| Pvap | 0.33 | kPa | 358.02 | Vapor p... |
| Pvap | 0.33 | kPa | 358.02 | Vapor p... |
| Pvap | 0.46 | kPa | 362.97 | Vapor p... |
| Pvap | 0.46 | kPa | 362.98 | Vapor p... |
| Pvap | 0.46 | kPa | 362.98 | Vapor p... |
Pressure Dependent Properties
| Property | Value | Unit | Pressure (kPa) | Source |
|---|---|---|---|---|
| Tboilr | 385.70 | K | 1.60 | NIST |
Similar Compounds
Find more compounds similar to 6-Octen-1-ol, 3,7-dimethyl-, (R)-.
Sources
- Crippen Method
- Crippen Method
- Vapor pressures and thermophysical properties of selected monoterpenoids
- Joback Method
- McGowan Method
- NIST Webbook
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