- InChI
- InChI=1S/C12H24O2/c1-2-3-4-5-6-9-12-13-10-7-8-11-14-12/h12H,2-11H2,1H3
- InChI Key
- JPISZFLCOGWKHT-UHFFFAOYSA-N
- Formula
- C12H24O2
- SMILES
- CCCCCCCC1OCCCCO1
- Molecular Weight1
- 200.32
- CAS
- 61732-92-1
- Other Names
-
- 2-Heptyl-1,3-dioxepane
- 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).
- ΔvapH : Enthalpy of vaporization at a given temperature (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° | -109.73 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -506.85 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 32.53 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 51.93 | kJ/mol | Joback Calculated Property |
| log10WS | -3.52 | Crippen Calculated Property | |
| logPoct/wat | 3.500 | Crippen Calculated Property | |
| McVol | 180.820 | ml/mol | McGowan Calculated Property |
| Pc | 2147.32 | kPa | Joback Calculated Property |
| Tboil | 551.68 | K | Joback Calculated Property |
| Tc | 748.95 | K | Joback Calculated Property |
| Tfus | 282.00 | K | Joback Calculated Property |
| Vc | 0.674 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [467.93; 575.13] | J/mol×K | [551.68; 748.95] | 
|
| Cp,gas | 467.93 | J/mol×K | 551.68 | Joback Calculated Property |
| Cp,gas | 488.28 | J/mol×K | 584.56 | Joback Calculated Property |
| Cp,gas | 507.61 | J/mol×K | 617.44 | Joback Calculated Property |
| Cp,gas | 525.94 | J/mol×K | 650.32 | Joback Calculated Property |
| Cp,gas | 543.29 | J/mol×K | 683.19 | Joback Calculated Property |
| Cp,gas | 559.68 | J/mol×K | 716.07 | Joback Calculated Property |
| Cp,gas | 575.13 | J/mol×K | 748.95 | Joback Calculated Property |
| η | [0.0001811; 0.0086681] | Pa×s | [282.00; 551.68] |
|
| η | 0.0086681 | Pa×s | 282.00 | Joback Calculated Property |
| η | 0.0029203 | Pa×s | 326.95 | Joback Calculated Property |
| η | 0.0012798 | Pa×s | 371.89 | Joback Calculated Property |
| η | 0.0006701 | Pa×s | 416.84 | Joback Calculated Property |
| η | 0.0003979 | Pa×s | 461.79 | Joback Calculated Property |
| η | 0.0002592 | Pa×s | 506.73 | Joback Calculated Property |
| η | 0.0001811 | Pa×s | 551.68 | Joback Calculated Property |
| ΔvapH | 70.30 | kJ/mol | 350.50 | NIST |
Similar Compounds
Find more compounds similar to 1,3-Dioxepane, 2-heptyl-.
Sources
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