- InChI
- InChI=1S/C6H12O3/c7-5-3-1-2-4-6(8)9/h7H,1-5H2,(H,8,9)
- InChI Key
- IWHLYPDWHHPVAA-UHFFFAOYSA-N
- Formula
- C6H12O3
- SMILES
- O=C(O)CCCCCO
- Molecular Weight1
- 132.16
- CAS
- 1191-25-9
- Other Names
-
- 6-Hydroxycaproic acid
- 6-Hydroxyhexanoic acid
- 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).
- ΔfH°solid : Solid phase 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 | 0.8314 | Relay (1.0) Calculated Property | |
| ΔfG° | -402.92 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -661.45 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfH°solid | -786.00 ± 3.00 | kJ/mol | NIST |
| ΔfusH° | 21.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.45 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.05 | eV | Relay (1.0) Calculated Property |
| log10WS | 0.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 0.624 | Crippen Calculated Property | |
| McVol | 108.710 | ml/mol | McGowan Calculated Property |
| Pc | 4178.49 | kPa | Joback Calculated Property |
| Tboil | 541.55 | K | Relay (1.0) Calculated Property |
| Tc | 762.44 | K | Relay (1.0) Calculated Property |
| Tfus | 351.20 | K | Relay (1.0) Calculated Property |
| Vc | 0.395 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [267.77; 309.68] | J/mol×K | [574.91; 740.78] | 
|
| Cp,gas | 267.77 | J/mol×K | 574.91 | Joback Calculated Property |
| Cp,gas | 275.55 | J/mol×K | 602.56 | Joback Calculated Property |
| Cp,gas | 283.00 | J/mol×K | 630.20 | Joback Calculated Property |
| Cp,gas | 290.13 | J/mol×K | 657.85 | Joback Calculated Property |
| Cp,gas | 296.95 | J/mol×K | 685.49 | Joback Calculated Property |
| Cp,gas | 303.46 | J/mol×K | 713.14 | Joback Calculated Property |
| Cp,gas | 309.68 | J/mol×K | 740.78 | Joback Calculated Property |
| η | [0.0000531; 0.0199932] | Pa×s | [328.95; 574.91] |
|
| η | 0.0199932 | Pa×s | 328.95 | Joback Calculated Property |
| η | 0.0043019 | Pa×s | 369.94 | Joback Calculated Property |
| η | 0.0012576 | Pa×s | 410.94 | Joback Calculated Property |
| η | 0.0004596 | Pa×s | 451.93 | Joback Calculated Property |
| η | 0.0001985 | Pa×s | 492.92 | Joback Calculated Property |
| η | 0.0000976 | Pa×s | 533.92 | Joback Calculated Property |
| η | 0.0000531 | Pa×s | 574.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Hexanoic acid, 6-hydroxy-.
Sources
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