- InChI
- InChI=1S/C15H26O4/c16-14-10-8-6-4-2-1-3-5-7-9-11-15(17)19-13-12-18-14/h1-13H2
- InChI Key
- XRHCAGNSDHCHFJ-UHFFFAOYSA-N
- Formula
- C15H26O4
- SMILES
- O=C1CCCCCCCCCCCC(=O)OCCO1
- Molecular Weight1
- 270.36
- CAS
- 105-95-3
- Other Names
-
- 1,4-Dioxacycloheptadecane-5,17-dione
- Astratone
- Ethylene undecane dicarboxylate
- Musk T
- Tridecanedioic acid, cyclic ethylene ester
- 1,11-Undecanedicarboxylic acid, ester with ethylene glycol
- Emeressence 1150
- 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 | 0.4615 | Relay (... Calculated Property | |
| ΔfG° | -442.94 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -896.92 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 17.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.75 | kJ/mol | Relay (... Calculated Property |
| IE | 9.25 | eV | Relay (... Calculated Property |
| log10WS | -3.51 | Relay (... Calculated Property | |
| logPoct/wat | 3.377 | Crippen Calculated Property | |
| McVol | 226.230 | ml/mol | McGowan Calculated Property |
| Pc | 2282.77 | kPa | Joback Calculated Property |
| Inp | 1988.60 | NIST | |
| Tboil | 697.86 | K | Relay (... Calculated Property |
| Tc | 885.42 | K | Relay (... Calculated Property |
| Tfus | 379.26 | K | Relay (... Calculated Property |
| Vc | 0.733 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [748.62; 839.93] | J/mol×K | [803.33; 1084.74] | 
|
| Cp,gas | 748.62 | J/mol×K | 803.33 | Joback Calculated Property |
| Cp,gas | 773.82 | J/mol×K | 850.23 | Joback Calculated Property |
| Cp,gas | 795.34 | J/mol×K | 897.13 | Joback Calculated Property |
| Cp,gas | 812.93 | J/mol×K | 944.03 | Joback Calculated Property |
| Cp,gas | 826.38 | J/mol×K | 990.94 | Joback Calculated Property |
| Cp,gas | 835.45 | J/mol×K | 1037.84 | Joback Calculated Property |
| Cp,gas | 839.93 | J/mol×K | 1084.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethylene brassylate.
Sources
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