- InChI
- InChI=1S/C15H32O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h13-14,16H,6-12H2,1-5H3
- InChI Key
- NUKWKMGANFONQP-UHFFFAOYSA-N
- Formula
- C15H32O
- SMILES
- CCC(C)(O)CCCC(C)CCCC(C)C
- Molecular Weight1
- 228.41
- CAS
- 7278-65-1
- Other Names
-
- Hexahydronerolidol
- Nerolidol, hexahydro-
- 3,7,11-Trimethyldodecan-3-ol
- 3,7,11-Trimethyl-3-dodecanol
- 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.
- 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 |
|---|---|---|---|
| ΔfG° | -63.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -524.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 63.59 | kJ/mol | Joback Calculated Property |
| log10WS | -4.99 | Crippen Calculated Property | |
| logPoct/wat | 4.780 | Crippen Calculated Property | |
| McVol | 228.080 | ml/mol | McGowan Calculated Property |
| Pc | 1561.05 | kPa | Joback Calculated Property |
| Inp | 1536.00 | NIST | |
| I | 1797.00 | NIST | |
| Tboil | 630.67 | K | Joback Calculated Property |
| Tc | 799.11 | K | Joback Calculated Property |
| Tfus | 292.05 | K | Joback Calculated Property |
| Vc | 0.872 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [640.24; 733.15] | J/mol×K | [630.67; 799.11] | 
|
| Cp,gas | 640.24 | J/mol×K | 630.67 | Joback Calculated Property |
| Cp,gas | 657.63 | J/mol×K | 658.74 | Joback Calculated Property |
| Cp,gas | 674.21 | J/mol×K | 686.82 | Joback Calculated Property |
| Cp,gas | 690.02 | J/mol×K | 714.89 | Joback Calculated Property |
| Cp,gas | 705.09 | J/mol×K | 742.96 | Joback Calculated Property |
| Cp,gas | 719.46 | J/mol×K | 771.04 | Joback Calculated Property |
| Cp,gas | 733.15 | J/mol×K | 799.11 | Joback Calculated Property |
| η | [0.0000381; 0.0381944] | Pa×s | [292.05; 630.67] |
|
| η | 0.0381944 | Pa×s | 292.05 | Joback Calculated Property |
| η | 0.0047515 | Pa×s | 348.49 | Joback Calculated Property |
| η | 0.0010568 | Pa×s | 404.92 | Joback Calculated Property |
| η | 0.0003395 | Pa×s | 461.36 | Joback Calculated Property |
| η | 0.0001397 | Pa×s | 517.80 | Joback Calculated Property |
| η | 0.0000685 | Pa×s | 574.23 | Joback Calculated Property |
| η | 0.0000381 | Pa×s | 630.67 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Dodecanol, 3,7,11-trimethyl-.
Sources
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