- 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
- ω : Acentric Factor.
- 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).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.6333 | Relay (1.0) Calculated Property | |
| ΔfG° | -34.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -336.55 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 21.11 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 71.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.53 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.65 | Relay (1.0) 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 | 498.90 | K | Relay (1.0) Calculated Property |
| Tc | 676.89 | K | Relay (1.0) Calculated Property |
| Tfus | 221.16 | K | Relay (1.0) Calculated Property |
| Vc | 0.531 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
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
- Cheméo Relay (1.0)
- Crippen Method
- Crippen Method
- Vapor pressures and thermophysical properties of selected monoterpenoids
- Joback Method
- McGowan Method
- NIST Webbook
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