- InChI
- InChI=1S/C16H20BrNO2/c17-11-7-3-1-2-4-8-12-18-15(19)13-9-5-6-10-14(13)16(18)20/h5-6,9-10H,1-4,7-8,11-12H2
- InChI Key
- LAMUQORCSIHVMC-UHFFFAOYSA-N
- Formula
- C16H20BrNO2
- SMILES
- O=C1c2ccccc2C(=O)N1CCCCCCCCBr
- Molecular Weight1
- 338.24
- CAS
- 17702-83-9
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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).
- 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 | 0.9061 | Relay (1.0) Calculated Property | |
| ΔfG° | -16.46 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -351.68 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 95.72 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.44 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.33 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.018 | Crippen Calculated Property | |
| McVol | 232.300 | ml/mol | McGowan Calculated Property |
| Pc | 2009.17 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 658.69 | K | Relay (1.0) Calculated Property |
| Tc | 924.78 | K | Relay (1.0) Calculated Property |
| Tfus | 363.25 | K | Relay (1.0) Calculated Property |
| Vc | 0.854 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to N-(8-Bromooctyl)phthalimide.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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