- InChI
- InChI=1S/C8H16O2/c1-3-4-5-6-8(2)10-7-9/h7-8H,3-6H2,1-2H3
- InChI Key
- SEIYVCWCDDKKIS-UHFFFAOYSA-N
- Formula
- C8H16O2
- SMILES
- CCCCCC(C)OC=O
- Molecular Weight1
- 144.21
- CAS
- 103884-53-3
- 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).
- 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 | 0.5130 | Relay (1.0) Calculated Property | |
| ΔfG° | -243.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -498.19 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 19.00 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 50.11 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.32 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.75 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.128 | Crippen Calculated Property | |
| McVol | 131.020 | ml/mol | McGowan Calculated Property |
| Pc | 2600.43 | kPa | Joback Calculated Property |
| Inp | 969.40 | NIST | |
| Tboil | 420.27 | K | Relay (1.0) Calculated Property |
| Tc | 601.28 | K | Relay (1.0) Calculated Property |
| Tfus | 218.65 | K | Relay (1.0) Calculated Property |
| Vc | 0.494 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.15; 333.10] | J/mol×K | [439.72; 612.35] | 
|
| Cp,gas | 268.15 | J/mol×K | 439.72 | Joback Calculated Property |
| Cp,gas | 280.30 | J/mol×K | 468.49 | Joback Calculated Property |
| Cp,gas | 291.90 | J/mol×K | 497.26 | Joback Calculated Property |
| Cp,gas | 302.96 | J/mol×K | 526.04 | Joback Calculated Property |
| Cp,gas | 313.50 | J/mol×K | 554.81 | Joback Calculated Property |
| Cp,gas | 323.54 | J/mol×K | 583.58 | Joback Calculated Property |
| Cp,gas | 333.10 | J/mol×K | 612.35 | Joback Calculated Property |
| η | [0.0003763; 0.0036765] | Pa×s | [223.62; 439.72] |
|
| η | 0.0036765 | Pa×s | 223.62 | Joback Calculated Property |
| η | 0.0019321 | Pa×s | 259.64 | Joback Calculated Property |
| η | 0.0011877 | Pa×s | 295.65 | Joback Calculated Property |
| η | 0.0008114 | Pa×s | 331.67 | Joback Calculated Property |
| η | 0.0005973 | Pa×s | 367.69 | Joback Calculated Property |
| η | 0.0004644 | Pa×s | 403.70 | Joback Calculated Property |
| η | 0.0003763 | Pa×s | 439.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Heptan-2-yl formate.
Sources
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