- InChI
- InChI=1S/C3H8O2/c1-3(2)5-4/h3-4H,1-2H3
- InChI Key
- SGJUFIMCHSLMRJ-UHFFFAOYSA-N
- Formula
- C3H8O2
- SMILES
- CC(C)OO
- Molecular Weight1
- 76.09
- CAS
- 3031-75-2
- Other Names
-
- Isopropyl hydroperoxide
- (CH3)2CHOOH
- 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).
- 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° | -269.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -197.10 | kJ/mol | NIST |
| ΔfusH° | 5.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.97 | kJ/mol | Joback Calculated Property |
| log10WS | -0.59 | Crippen Calculated Property | |
| logPoct/wat | 0.884 | Crippen Calculated Property | |
| McVol | 64.870 | ml/mol | McGowan Calculated Property |
| Pc | 4938.44 | kPa | Joback Calculated Property |
| Tboil | 382.20 | K | Joback Calculated Property |
| Tc | 548.82 | K | Joback Calculated Property |
| Tfus | 191.62 | K | Joback Calculated Property |
| Vc | 0.234 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [120.53; 152.86] | J/mol×K | [382.20; 548.82] | 
|
| Cp,gas | 120.53 | J/mol×K | 382.20 | Joback Calculated Property |
| Cp,gas | 126.27 | J/mol×K | 409.97 | Joback Calculated Property |
| Cp,gas | 131.87 | J/mol×K | 437.74 | Joback Calculated Property |
| Cp,gas | 137.33 | J/mol×K | 465.51 | Joback Calculated Property |
| Cp,gas | 142.65 | J/mol×K | 493.28 | Joback Calculated Property |
| Cp,gas | 147.83 | J/mol×K | 521.05 | Joback Calculated Property |
| Cp,gas | 152.86 | J/mol×K | 548.82 | Joback Calculated Property |
| η | [0.0003050; 0.1898932] | Pa×s | [191.62; 382.20] |
|
| η | 0.1898932 | Pa×s | 191.62 | Joback Calculated Property |
| η | 0.0303197 | Pa×s | 223.38 | Joback Calculated Property |
| η | 0.0076441 | Pa×s | 255.15 | Joback Calculated Property |
| η | 0.0026147 | Pa×s | 286.91 | Joback Calculated Property |
| η | 0.0011076 | Pa×s | 318.67 | Joback Calculated Property |
| η | 0.0005483 | Pa×s | 350.44 | Joback Calculated Property |
| η | 0.0003050 | Pa×s | 382.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hydroperoxide, 1-methylethyl.
Sources
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