- InChI
- InChI=1S/C18H29NO/c1-16(2,3)12-10-13(17(4,5)6)15(19-20)14(11-12)18(7,8)9/h10-11H,1-9H3
- InChI Key
- OSICDPWAPKXXHT-UHFFFAOYSA-N
- Formula
- C18H29NO
- SMILES
-
CC(C)(C)c1cc(C(C)(C)C)c(N=O)c(
C(C)(C)C)c1 - Molecular Weight1
- 275.43
- CAS
- 24973-59-9
- Other Names
-
- 2,4,6-Tri-t-butyl-nitrosobenzene
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔsubH° : Enthalpy of sublimation 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔcH°solid | -11019.30 ± 3.70 | kJ/mol | NIST |
| ΔfH°gas | -117.40 ± 5.40 | kJ/mol | NIST |
| ΔfH°solid | -208.40 ± 4.40 | kJ/mol | NIST |
| ΔsubH° | [91.00; 91.00] | kJ/mol |
|
| ΔsubH° | 91.00 ± 3.20 | kJ/mol | NIST |
| ΔsubH° | 91.00 ± 3.20 | kJ/mol | NIST |
| ΔvapH° | 65.13 | kJ/mol | Joback Calculated Property |
| IE | 8.69 | eV | NIST |
| log10WS | -6.17 | Crippen Calculated Property | |
| logPoct/wat | 5.977 | Crippen Calculated Property | |
| McVol | 252.270 | ml/mol | McGowan Calculated Property |
| Pc | 1455.68 | kPa | Joback Calculated Property |
| Tboil | 706.57 | K | Joback Calculated Property |
| Tc | 920.64 | K | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,3,5-tri(tert-butyl)-2-nitrosobenzene.
Sources
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