- InChI
- InChI=1S/C10H20O/c1-5-6-7-9(11)8-10(2,3)4/h5-8H2,1-4H3
- InChI Key
- JAODHAABODLKEG-UHFFFAOYSA-N
- Formula
- C10H20O
- SMILES
- CCCCC(=O)CC(C)(C)C
- Molecular Weight1
- 156.27
- CAS
- 22319-52-4
- Other Names
-
- 2,2-dimethyl-4-octanone
- 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 | 0.4665 | Relay (... Calculated Property | |
| ΔfG° | -92.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -400.51 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 15.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.14 | kJ/mol | Relay (... Calculated Property |
| IE | 8.97 | eV | Relay (... Calculated Property |
| log10WS | -3.00 | Relay (... Calculated Property | |
| logPoct/wat | 3.182 | Crippen Calculated Property | |
| McVol | 153.330 | ml/mol | McGowan Calculated Property |
| Pc | 2276.24 | kPa | Joback Calculated Property |
| Tboil | 453.53 | K | Relay (... Calculated Property |
| Tc | 631.56 | K | Relay (... Calculated Property |
| Tfus | 272.45 | K | Relay (... Calculated Property |
| Vc | 0.555 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [344.63; 427.35] | J/mol×K | [478.84; 662.03] | 
|
| Cp,gas | 344.63 | J/mol×K | 478.84 | Joback Calculated Property |
| Cp,gas | 360.24 | J/mol×K | 509.37 | Joback Calculated Property |
| Cp,gas | 375.08 | J/mol×K | 539.90 | Joback Calculated Property |
| Cp,gas | 389.19 | J/mol×K | 570.43 | Joback Calculated Property |
| Cp,gas | 402.58 | J/mol×K | 600.97 | Joback Calculated Property |
| Cp,gas | 415.29 | J/mol×K | 631.50 | Joback Calculated Property |
| Cp,gas | 427.35 | J/mol×K | 662.03 | Joback Calculated Property |
| η | [0.0002654; 0.0064632] | Pa×s | [254.81; 478.84] |
|
| η | 0.0064632 | Pa×s | 254.81 | Joback Calculated Property |
| η | 0.0027020 | Pa×s | 292.15 | Joback Calculated Property |
| η | 0.0013765 | Pa×s | 329.49 | Joback Calculated Property |
| η | 0.0008044 | Pa×s | 366.82 | Joback Calculated Property |
| η | 0.0005192 | Pa×s | 404.16 | Joback Calculated Property |
| η | 0.0003608 | Pa×s | 441.50 | Joback Calculated Property |
| η | 0.0002654 | Pa×s | 478.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-t-Butyl-2-hexanone.
Sources
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