- InChI
- InChI=1S/C6H9NO2/c8-7(9)5-6-3-1-2-4-6/h5H,1-4H2
- InChI Key
- FCFLHKHBKPPQQY-UHFFFAOYSA-N
- Formula
- C6H9NO2
- SMILES
- O=[N+]([O-])C=C1CCCC1
- Molecular Weight1
- 127.14
- CAS
- 27861-40-1
- 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).
- 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 | 0.3824 | Relay (... Calculated Property | |
| ΔfG° | 124.91 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -7.80 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 15.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.61 | kJ/mol | Relay (... Calculated Property |
| IE | 9.83 | eV | Relay (... Calculated Property |
| log10WS | -2.20 | Relay (... Calculated Property | |
| logPoct/wat | 1.721 | Crippen Calculated Property | |
| McVol | 97.660 | ml/mol | McGowan Calculated Property |
| Pc | 4216.56 | kPa | Joback Calculated Property |
| Tboil | 474.63 | K | Relay (... Calculated Property |
| Tc | 703.79 | K | Relay (... Calculated Property |
| Tfus | 292.82 | K | Relay (... Calculated Property |
| Vc | 0.322 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [214.99; 278.10] | J/mol×K | [515.11; 758.94] | 
|
| Cp,gas | 214.99 | J/mol×K | 515.11 | Joback Calculated Property |
| Cp,gas | 227.66 | J/mol×K | 555.75 | Joback Calculated Property |
| Cp,gas | 239.39 | J/mol×K | 596.39 | Joback Calculated Property |
| Cp,gas | 250.23 | J/mol×K | 637.03 | Joback Calculated Property |
| Cp,gas | 260.26 | J/mol×K | 677.67 | Joback Calculated Property |
| Cp,gas | 269.53 | J/mol×K | 718.30 | Joback Calculated Property |
| Cp,gas | 278.10 | J/mol×K | 758.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclopentane, (nitromethylene)-.
Sources
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