- InChI
- InChI=1S/C4H10O3/c5-1-4(2-6)3-7/h4-7H,1-3H2
- InChI Key
- SFRDXVJWXWOTEW-UHFFFAOYSA-N
- Formula
- C4H10O3
- SMILES
- OCC(CO)CO
- Molecular Weight1
- 106.12
- CAS
- 4704-94-3
- Other Names
-
- Propane, 1,3-dihydroxy-2-hydroxymethyl-
- 2-(hydroxymethyl)propane-1,3-diol
- 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° | -430.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -587.86 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 74.15 | kJ/mol | Joback Calculated Property |
| log10WS | 0.95 | Crippen Calculated Property | |
| logPoct/wat | -1.420 | Crippen Calculated Property | |
| McVol | 84.830 | ml/mol | McGowan Calculated Property |
| Pc | 5756.64 | kPa | Joback Calculated Property |
| Tboil | 567.02 | K | Joback Calculated Property |
| Tc | 725.28 | K | Joback Calculated Property |
| Tfus | 302.30 | K | Joback Calculated Property |
| Vc | 0.310 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [211.49; 243.37] | J/mol×K | [567.02; 725.28] | 
|
| Cp,gas | 211.49 | J/mol×K | 567.02 | Joback Calculated Property |
| Cp,gas | 217.38 | J/mol×K | 593.40 | Joback Calculated Property |
| Cp,gas | 223.03 | J/mol×K | 619.77 | Joback Calculated Property |
| Cp,gas | 228.44 | J/mol×K | 646.15 | Joback Calculated Property |
| Cp,gas | 233.64 | J/mol×K | 672.52 | Joback Calculated Property |
| Cp,gas | 238.61 | J/mol×K | 698.90 | Joback Calculated Property |
| Cp,gas | 243.37 | J/mol×K | 725.28 | Joback Calculated Property |
| η | [0.0000216; 0.1910150] | Pa×s | [302.30; 567.02] |
|
| η | 0.1910150 | Pa×s | 302.30 | Joback Calculated Property |
| η | 0.0160153 | Pa×s | 346.42 | Joback Calculated Property |
| η | 0.0023509 | Pa×s | 390.54 | Joback Calculated Property |
| η | 0.0005095 | Pa×s | 434.66 | Joback Calculated Property |
| η | 0.0001463 | Pa×s | 478.78 | Joback Calculated Property |
| η | 0.0000519 | Pa×s | 522.90 | Joback Calculated Property |
| η | 0.0000216 | Pa×s | 567.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3-Propanediol, 2-(hydroxymethyl)-.
Sources
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