- InChI
- InChI=1S/C10H18O2/c1-4-6-7-8-10(5-2)12-9(3)11/h5,10H,2,4,6-8H2,1,3H3
- InChI Key
- DOJDQRFOTHOBEK-UHFFFAOYSA-N
- Formula
- C10H18O2
- SMILES
- C=CC(CCCCC)OC(C)=O
- Molecular Weight1
- 170.25
- CAS
- 2442-10-6
- Other Names
-
- 1-Octen-3-ol, acetate
- Amyl vinyl carbinol acetate
- Amyl vinyl carbinyl acetate
- 1-Pentylallyl acetate
- 1-Octenyl-3-acetate
- Oct-1-en-3-yl acetate
- Octen-3-yl acetate
- 1-Oct-3-enylacetate
- 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).
- Inp : Non-polar retention indices.
- 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° | -115.20 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -374.38 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 19.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.95 | kJ/mol | Joback Calculated Property |
| log10WS | -2.84 | Crippen Calculated Property | |
| logPoct/wat | 2.684 | Crippen Calculated Property | |
| McVol | 154.900 | ml/mol | McGowan Calculated Property |
| Pc | 2306.95 | kPa | Joback Calculated Property |
| Inp | [1083.00; 1120.00] |
|
|
| Inp | 1089.00 | NIST | |
| Inp | 1089.50 | NIST | |
| Inp | 1083.00 | NIST | |
| Inp | 1111.00 | NIST | |
| Inp | 1110.00 | NIST | |
| Inp | 1110.00 | NIST | |
| Inp | 1110.00 | NIST | |
| Inp | 1112.00 | NIST | |
| Inp | 1112.00 | NIST | |
| Inp | 1116.00 | NIST | |
| Inp | 1119.00 | NIST | |
| Inp | 1094.00 | NIST | |
| Inp | 1114.00 | NIST | |
| Inp | 1110.00 | NIST | |
| Inp | 1120.00 | NIST | |
| Inp | 1111.00 | NIST | |
| Inp | 1104.90 | NIST | |
| Inp | 1114.00 | NIST | |
| Inp | 1097.00 | NIST | |
| Inp | 1113.00 | NIST | |
| Inp | 1115.00 | NIST | |
| Inp | 1111.00 | NIST | |
| Inp | 1106.00 | NIST | |
| Inp | 1106.00 | NIST | |
| Inp | 1094.00 | NIST | |
| Inp | 1113.00 | NIST | |
| Inp | 1092.00 | NIST | |
| Inp | 1099.00 | NIST | |
| Inp | 1108.00 | NIST | |
| Inp | 1094.00 | NIST | |
| Inp | 1093.00 | NIST | |
| Inp | 1113.00 | NIST | |
| Inp | 1097.00 | NIST | |
| Inp | 1094.00 | NIST | |
| Inp | 1100.00 | NIST | |
| Inp | 1115.00 | NIST | |
| Inp | 1111.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1113.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1113.00 | NIST | |
| Inp | 1115.00 | NIST | |
| Inp | 1113.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1110.00 | NIST | |
| Inp | 1094.00 | NIST | |
| Inp | 1105.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1100.00 | NIST | |
| Inp | 1086.00 | NIST | |
| Inp | 1115.00 | NIST | |
| Inp | 1094.00 | NIST | |
| I | [1365.00; 1401.90] |
|
|
| I | 1392.00 | NIST | |
| I | 1379.00 | NIST | |
| I | 1368.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1401.90 | NIST | |
| I | 1401.90 | NIST | |
| I | 1379.00 | NIST | |
| I | 1380.00 | NIST | |
| I | 1379.00 | NIST | |
| I | 1385.00 | NIST | |
| I | 1373.00 | NIST | |
| I | 1365.00 | NIST | |
| Tboil | 500.73 | K | Joback Calculated Property |
| Tc | 679.83 | K | Joback Calculated Property |
| Tfus | 257.86 | K | Joback Calculated Property |
| Vc | 0.595 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [350.06; 425.43] | J/mol×K | [500.73; 679.83] |
|
| Cp,gas | 350.06 | J/mol×K | 500.73 | Joback Calculated Property |
| Cp,gas | 364.01 | J/mol×K | 530.58 | Joback Calculated Property |
| Cp,gas | 377.40 | J/mol×K | 560.43 | Joback Calculated Property |
| Cp,gas | 390.22 | J/mol×K | 590.28 | Joback Calculated Property |
| Cp,gas | 402.50 | J/mol×K | 620.13 | Joback Calculated Property |
| Cp,gas | 414.23 | J/mol×K | 649.98 | Joback Calculated Property |
| Cp,gas | 425.43 | J/mol×K | 679.83 | Joback Calculated Property |
| η | [0.0002145; 0.0042919] | Pa×s | [257.86; 500.73] |
|
| η | 0.0042919 | Pa×s | 257.86 | Joback Calculated Property |
| η | 0.0018562 | Pa×s | 298.34 | Joback Calculated Property |
| η | 0.0009808 | Pa×s | 338.82 | Joback Calculated Property |
| η | 0.0005939 | Pa×s | 379.29 | Joback Calculated Property |
| η | 0.0003961 | Pa×s | 419.77 | Joback Calculated Property |
| η | 0.0002837 | Pa×s | 460.25 | Joback Calculated Property |
| η | 0.0002145 | Pa×s | 500.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1-Octen-3-yl-acetate.
Sources
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