- InChI
- InChI=1S/C19H36O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(21)17-22-18(2)20/h3-17H2,1-2H3
- InChI Key
- LSDQENKWCINLBH-UHFFFAOYSA-N
- Formula
- C19H36O3
- SMILES
- CCCCCCCCCCCCCCCC(=O)COC(C)=O
- Molecular Weight1
- 312.49
- CAS
- 116296-24-3
- 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).
- 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 | 0.9472 | Relay (1.0) Calculated Property | |
| ΔfG° | -330.19 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -863.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 50.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.09 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.41 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.10 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.600 | Crippen Calculated Property | |
| McVol | 287.580 | ml/mol | McGowan Calculated Property |
| Pc | 1130.62 | kPa | Joback Calculated Property |
| Tboil | 599.15 | K | Relay (1.0) Calculated Property |
| Tc | 782.57 | K | Relay (1.0) Calculated Property |
| Tfus | 330.26 | K | Relay (1.0) Calculated Property |
| Vc | 1.108 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [869.11; 964.25] | J/mol×K | [746.41; 921.91] | 
|
| Cp,gas | 869.11 | J/mol×K | 746.41 | Joback Calculated Property |
| Cp,gas | 887.25 | J/mol×K | 775.66 | Joback Calculated Property |
| Cp,gas | 904.44 | J/mol×K | 804.91 | Joback Calculated Property |
| Cp,gas | 920.72 | J/mol×K | 834.16 | Joback Calculated Property |
| Cp,gas | 936.10 | J/mol×K | 863.41 | Joback Calculated Property |
| Cp,gas | 950.60 | J/mol×K | 892.66 | Joback Calculated Property |
| Cp,gas | 964.25 | J/mol×K | 921.91 | Joback Calculated Property |
| η | [0.0000725; 0.0018520] | Pa×s | [396.15; 746.41] |
|
| η | 0.0018520 | Pa×s | 396.15 | Joback Calculated Property |
| η | 0.0007630 | Pa×s | 454.53 | Joback Calculated Property |
| η | 0.0003846 | Pa×s | 512.90 | Joback Calculated Property |
| η | 0.0002230 | Pa×s | 571.28 | Joback Calculated Property |
| η | 0.0001431 | Pa×s | 629.66 | Joback Calculated Property |
| η | 0.0000990 | Pa×s | 688.03 | Joback Calculated Property |
| η | 0.0000725 | Pa×s | 746.41 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Heptadecanone-1-ol, acetate.
Sources
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