- InChI
- InChI=1S/C14H10N2O3/c17-8-15-11-1-3-13-9(6-11)5-10-7-12(16(18)19)2-4-14(10)13/h1-4,6-8H,5H2,(H,15,17)
- InChI Key
- NNVUDKLVHMGGOQ-UHFFFAOYSA-N
- Formula
- C14H10N2O3
- SMILES
-
O=CNc1ccc2c(c1)Cc1cc([N+](=O)[
O-])ccc1-2 - Molecular Weight1
- 254.24
- CAS
- 6583-71-7
- 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 | 0.7666 | Relay (1.0) Calculated Property | |
| ΔfG° | 371.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 33.32 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.55 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 121.75 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.43 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.86 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.734 | Crippen Calculated Property | |
| McVol | 178.710 | ml/mol | McGowan Calculated Property |
| Pc | 3272.78 | kPa | Joback Calculated Property |
| Tboil | 688.26 | K | Relay (1.0) Calculated Property |
| Tc | 1047.86 | K | Relay (1.0) Calculated Property |
| Tfus | 471.63 | K | Relay (1.0) Calculated Property |
| Vc | 0.640 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [501.05; 557.88] | J/mol×K | [846.54; 1105.79] | 
|
| Cp,gas | 501.05 | J/mol×K | 846.54 | Joback Calculated Property |
| Cp,gas | 511.50 | J/mol×K | 889.75 | Joback Calculated Property |
| Cp,gas | 521.35 | J/mol×K | 932.96 | Joback Calculated Property |
| Cp,gas | 530.75 | J/mol×K | 976.17 | Joback Calculated Property |
| Cp,gas | 539.87 | J/mol×K | 1019.38 | Joback Calculated Property |
| Cp,gas | 548.86 | J/mol×K | 1062.59 | Joback Calculated Property |
| Cp,gas | 557.88 | J/mol×K | 1105.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Formamide, n-(7-nitrofluoren-2-yl)-.
Sources
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