- InChI
- InChI=1S/C19H27BrO5/c1-5-6-16(13(2)3)25-19(22)10-9-18(21)24-12-14-11-15(20)7-8-17(14)23-4/h7-8,11,13,16H,5-6,9-10,12H2,1-4H3
- InChI Key
- ANVGYEQLPHJOIC-UHFFFAOYSA-N
- Formula
- C19H27BrO5
- SMILES
-
CCCC(OC(=O)CCC(=O)OCc1cc(Br)cc
c1OC)C(C)C - Molecular Weight1
- 415.32
- 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.
- 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° | -361.15 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -827.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 43.23 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.87 | kJ/mol | Joback Calculated Property |
| log10WS | -5.83 | Crippen Calculated Property | |
| logPoct/wat | 4.649 | Crippen Calculated Property | |
| McVol | 293.060 | ml/mol | McGowan Calculated Property |
| Pc | 1501.15 | kPa | Joback Calculated Property |
| Inp | [2602.00; 2602.00] |
|
|
| Inp | 2602.00 | NIST | |
| Inp | 2602.00 | NIST | |
| Tboil | 911.04 | K | Joback Calculated Property |
| Tc | 1126.94 | K | Joback Calculated Property |
| Tfus | 551.70 | K | Joback Calculated Property |
| Vc | 1.107 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [887.11; 950.22] | J/mol×K | [911.04; 1126.94] |
|
| Cp,gas | 887.11 | J/mol×K | 911.04 | Joback Calculated Property |
| Cp,gas | 900.81 | J/mol×K | 947.02 | Joback Calculated Property |
| Cp,gas | 913.22 | J/mol×K | 983.01 | Joback Calculated Property |
| Cp,gas | 924.35 | J/mol×K | 1018.99 | Joback Calculated Property |
| Cp,gas | 934.22 | J/mol×K | 1054.98 | Joback Calculated Property |
| Cp,gas | 942.84 | J/mol×K | 1090.96 | Joback Calculated Property |
| Cp,gas | 950.22 | J/mol×K | 1126.94 | Joback Calculated Property |
| η | [0.0000314; 0.0003204] | Pa×s | [551.70; 911.04] |
|
| η | 0.0003204 | Pa×s | 551.70 | Joback Calculated Property |
| η | 0.0001800 | Pa×s | 611.59 | Joback Calculated Property |
| η | 0.0001120 | Pa×s | 671.48 | Joback Calculated Property |
| η | 0.0000754 | Pa×s | 731.37 | Joback Calculated Property |
| η | 0.0000539 | Pa×s | 791.26 | Joback Calculated Property |
| η | 0.0000403 | Pa×s | 851.15 | Joback Calculated Property |
| η | 0.0000314 | Pa×s | 911.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 5-bromo-2-methoxybenzyl 2-methylhex-3-yl ester.
Sources
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