- InChI
- InChI=1S/C10H20O2/c1-4-7-8-9-10(11-5-2)12-6-3/h7-8,10H,4-6,9H2,1-3H3/b8-7-
- InChI Key
- IOBHVJHSBREPFR-FPLPWBNLSA-N
- Formula
- C10H20O2
- SMILES
- CCC=CCC(OCC)OCC
- Molecular Weight1
- 172.26
- CAS
- 73545-18-3
- Other Names
-
- 3-Hexene, 1,1-diethoxy-, (Z)-
- cis-1,1-Diethoxy-3-hexene
- (3Z)-1,1-Diethoxy-3-hexene
- (Z)-3-Hexenal diethyl acetal
- 3-Hexene, 1,1-diethoxy-, (3Z)-
- (Z)-1,1-diethoxyhex-3-ene
- 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).
- I : 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 |
|---|---|---|---|
| ΔfG° | -98.90 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -402.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 20.71 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 42.24 | kJ/mol | Joback Calculated Property |
| log10WS | -2.64 | Crippen Calculated Property | |
| logPoct/wat | 2.742 | Crippen Calculated Property | |
| McVol | 159.200 | ml/mol | McGowan Calculated Property |
| Pc | 2159.31 | kPa | Joback Calculated Property |
| I | [1269.00; 1272.00] |
|
|
| I | 1269.00 | NIST | |
| I | 1272.00 | NIST | |
| I | 1269.00 | NIST | |
| I | 1272.00 | NIST | |
| Tboil | 476.76 | K | Joback Calculated Property |
| Tc | 650.07 | K | Joback Calculated Property |
| Tfus | 226.84 | K | Joback Calculated Property |
| Vc | 0.606 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [353.11; 433.28] | J/mol×K | [476.76; 650.07] |
|
| Cp,gas | 353.11 | J/mol×K | 476.76 | Joback Calculated Property |
| Cp,gas | 367.77 | J/mol×K | 505.64 | Joback Calculated Property |
| Cp,gas | 381.91 | J/mol×K | 534.53 | Joback Calculated Property |
| Cp,gas | 395.52 | J/mol×K | 563.41 | Joback Calculated Property |
| Cp,gas | 408.61 | J/mol×K | 592.30 | Joback Calculated Property |
| Cp,gas | 421.20 | J/mol×K | 621.18 | Joback Calculated Property |
| Cp,gas | 433.28 | J/mol×K | 650.07 | Joback Calculated Property |
| η | [0.0001354; 0.0044403] | Pa×s | [226.84; 476.76] |
|
| η | 0.0044403 | Pa×s | 226.84 | Joback Calculated Property |
| η | 0.0015806 | Pa×s | 268.49 | Joback Calculated Property |
| η | 0.0007426 | Pa×s | 310.15 | Joback Calculated Property |
| η | 0.0004172 | Pa×s | 351.80 | Joback Calculated Property |
| η | 0.0002648 | Pa×s | 393.45 | Joback Calculated Property |
| η | 0.0001834 | Pa×s | 435.11 | Joback Calculated Property |
| η | 0.0001354 | Pa×s | 476.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-3-Hexenal diethyl acetal.
Sources
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