- InChI
- InChI=1S/C14H13F14NO3/c15-9(16,11(19,20)13(23,24)25)7(30)29-5-3-1-2-4-6-32-8(31)10(17,18)12(21,22)14(26,27)28/h1-6H2,(H,29,30)
- InChI Key
- AIEANBIIGMZCRV-UHFFFAOYSA-N
- Formula
- C14H13F14NO3
- SMILES
-
O=C(NCCCCCCOC(=O)C(F)(F)C(F)(F
)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F )F - Molecular Weight1
- 509.24
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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).
- Inp : Non-polar retention indices.
- 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 | 0.8390 | Relay (1.0) Calculated Property | |
| ΔfG° | -2916.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -3568.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.22 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.21 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.95 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.872 | Crippen Calculated Property | |
| McVol | 251.890 | ml/mol | McGowan Calculated Property |
| Pc | 1144.44 | kPa | Joback Calculated Property |
| Inp | 1421.00 | NIST | |
| Tboil | 509.05 | K | Relay (1.0) Calculated Property |
| Tc | 648.30 | K | Relay (1.0) Calculated Property |
| Tfus | 340.26 | K | Relay (1.0) Calculated Property |
| Vc | 0.981 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [778.17; 837.43] | J/mol×K | [670.45; 823.46] | 
|
| Cp,gas | 778.17 | J/mol×K | 670.45 | Joback Calculated Property |
| Cp,gas | 789.93 | J/mol×K | 695.95 | Joback Calculated Property |
| Cp,gas | 800.85 | J/mol×K | 721.45 | Joback Calculated Property |
| Cp,gas | 811.01 | J/mol×K | 746.96 | Joback Calculated Property |
| Cp,gas | 820.45 | J/mol×K | 772.46 | Joback Calculated Property |
| Cp,gas | 829.24 | J/mol×K | 797.96 | Joback Calculated Property |
| Cp,gas | 837.43 | J/mol×K | 823.46 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 6-Amino-1-hexanol, N,O-bis(heptafluorobutyryl)-.
Sources
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