- InChI
- InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)7(10)6(3-4)9(13)14/h2-3,10H,1H3
- InChI Key
- HOYRZHJJAHRMLL-UHFFFAOYSA-N
- Formula
- C7H6N2O5
- SMILES
-
Cc1cc([N+](=O)[O-])c(O)c([N+](
=O)[O-])c1 - Molecular Weight1
- 198.13
- CAS
- 609-93-8
- Other Names
-
- p-Cresol, 2,6-dinitro-
- 2,6-Dinitro-p-cresol
- 2,6-Dinitro-4-methylphenol
- 4-Methyl-2,6-dinitrophenol
- Dinitro-p-cresol
- DNPC
- Victoria Orange
- Victoria Yellow
- 2,6-Dinitro-4-cresol
- NSC 33870
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- ΔfH°solid : Solid phase 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).
- 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 |
|---|---|---|---|
| ΔcH°solid | -3372.80 | kJ/mol | NIST |
| ΔfG° | 17.69 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -173.05 | kJ/mol | Joback Calculated Property |
| ΔfH°solid | -239.00 | kJ/mol | NIST |
| ΔfusH° | 35.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.97 | kJ/mol | Joback Calculated Property |
| log10WS | -2.80 | Crippen Calculated Property | |
| logPoct/wat | 1.517 | Crippen Calculated Property | |
| McVol | 126.440 | ml/mol | McGowan Calculated Property |
| Pc | 4987.39 | kPa | Joback Calculated Property |
| Tboil | 780.50 | K | Joback Calculated Property |
| Tc | 1059.76 | K | Joback Calculated Property |
| Tfus | 619.05 | K | Joback Calculated Property |
| Vc | 0.450 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [334.95; 379.80] | J/mol×K | [780.50; 1059.76] | 
|
| Cp,gas | 334.95 | J/mol×K | 780.50 | Joback Calculated Property |
| Cp,gas | 343.28 | J/mol×K | 827.04 | Joback Calculated Property |
| Cp,gas | 351.09 | J/mol×K | 873.59 | Joback Calculated Property |
| Cp,gas | 358.52 | J/mol×K | 920.13 | Joback Calculated Property |
| Cp,gas | 365.69 | J/mol×K | 966.67 | Joback Calculated Property |
| Cp,gas | 372.74 | J/mol×K | 1013.21 | Joback Calculated Property |
| Cp,gas | 379.80 | J/mol×K | 1059.76 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Phenol, 4-methyl-2,6-dinitro-.
Sources
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