- InChI
- InChI=1S/C10H10BrNO/c11-8-3-5-9(6-4-8)12-10(13)7-1-2-7/h3-7H,1-2H2,(H,12,13)
- InChI Key
- CYBVEZPTHHVBTO-UHFFFAOYSA-N
- Formula
- C10H10BrNO
- SMILES
- O=C(Nc1ccc(Br)cc1)C1CC1
- Molecular Weight1
- 240.10
- 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 | 0.5444 | Relay (... Calculated Property | |
| ΔfG° | 171.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -56.19 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 25.43 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.05 | kJ/mol | Relay (... Calculated Property |
| IE | 8.25 | eV | Relay (... Calculated Property |
| log10WS | -3.37 | Relay (... Calculated Property | |
| logPoct/wat | 2.798 | Crippen Calculated Property | |
| McVol | 146.190 | ml/mol | McGowan Calculated Property |
| Pc | 3970.51 | kPa | Joback Calculated Property |
| Inp | 1888.00 | NIST | |
| Tboil | 584.95 | K | Relay (... Calculated Property |
| Tc | 861.74 | K | Relay (... Calculated Property |
| Tfus | 413.29 | K | Relay (... Calculated Property |
| Vc | 0.516 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [344.68; 406.81] | J/mol×K | [636.80; 882.14] | 
|
| Cp,gas | 344.68 | J/mol×K | 636.80 | Joback Calculated Property |
| Cp,gas | 357.30 | J/mol×K | 677.69 | Joback Calculated Property |
| Cp,gas | 368.89 | J/mol×K | 718.58 | Joback Calculated Property |
| Cp,gas | 379.53 | J/mol×K | 759.47 | Joback Calculated Property |
| Cp,gas | 389.33 | J/mol×K | 800.36 | Joback Calculated Property |
| Cp,gas | 398.39 | J/mol×K | 841.25 | Joback Calculated Property |
| Cp,gas | 406.81 | J/mol×K | 882.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopropanecarboxamide, N-(4-bromophenyl)-.
Sources
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