- InChI
- InChI=1S/C10H12N2O5/c1-10(2,3)7-4-6(11(14)15)5-8(9(7)13)12(16)17/h4-5,13H,1-3H3
- InChI Key
- IIPZYDQGBIWLBU-UHFFFAOYSA-N
- Formula
- C10H12N2O5
- SMILES
-
CC(C)(C)c1cc([N+](=O)[O-])cc([
N+](=O)[O-])c1O - Molecular Weight1
- 240.21
- CAS
- 1420-07-1
- Other Names
-
- Phenol, 2-(1,1-dimethylethyl)-4,6-dinitro-
- Phenol, 2-tert-butyl-4,6-dinitro-
- Dinoterbe
- Stirpan forte
- 2-tert-Butyl-4,6-dinitrophenol
- 2,4-Dinitro-6-tert-butylphenol
- Phenol, o-tert-butyl-4,6-dinitro-
- Phenol, o-t-butyl-4,6-dinitro-
- 2-(1,1-Dimethylethyl)-4,6-dinitrophenol
- Dntbp
- Herbogil
- Phenol, 2-t-butyl-4,6-dinitro-
- 4,6-Dinitro-2-tert-butylphenol
- NSC 166496
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | 45.79 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -243.72 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 36.01 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 86.35 | kJ/mol | Joback Calculated Property |
| log10WS | -3.63 | Crippen Calculated Property | |
| logPoct/wat | 2.506 | Crippen Calculated Property | |
| McVol | 168.710 | ml/mol | McGowan Calculated Property |
| Pc | 3522.09 | kPa | Joback Calculated Property |
| Tboil | 845.91 | K | Joback Calculated Property |
| Tc | 1120.33 | K | Joback Calculated Property |
| Tfus | 655.28 | K | Joback Calculated Property |
| Vc | 0.607 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [492.25; 553.14] | J/mol×K | [845.91; 1120.33] | 
|
| Cp,gas | 492.25 | J/mol×K | 845.91 | Joback Calculated Property |
| Cp,gas | 503.08 | J/mol×K | 891.65 | Joback Calculated Property |
| Cp,gas | 513.38 | J/mol×K | 937.38 | Joback Calculated Property |
| Cp,gas | 523.35 | J/mol×K | 983.12 | Joback Calculated Property |
| Cp,gas | 533.17 | J/mol×K | 1028.86 | Joback Calculated Property |
| Cp,gas | 543.04 | J/mol×K | 1074.59 | Joback Calculated Property |
| Cp,gas | 553.14 | J/mol×K | 1120.33 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dinoterb.
Sources
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