- InChI
- InChI=1S/C8H18N2O2/c1-7(2,3)11-9-10-12-8(4,5)6/h1-6H3/b10-9+
- InChI Key
- OAPFBXRHYINFDV-MDZDMXLPSA-N
- Formula
- C8H18N2O2
- SMILES
- CC(C)(C)ON=NOC(C)(C)C
- Molecular Weight1
- 174.24
- CAS
- 82554-97-0
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- 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).
- 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).
- 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 | 0.6229 | Relay (1.0) Calculated Property | |
| ΔcH°solid | -5458.00 ± 7.50 | kJ/mol | NIST |
| ΔfG° | 130.98 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -189.00 ± 12.00 | kJ/mol | NIST |
| ΔfH°solid | -263.00 ± 12.00 | kJ/mol | NIST |
| ΔsubH° | 74.00 ± 1.00 | kJ/mol | NIST |
| ΔvapH° | 52.19 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.33 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.03 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.899 | Crippen Calculated Property | |
| McVol | 150.980 | ml/mol | McGowan Calculated Property |
| Pc | 1985.89 | kPa | Joback Calculated Property |
| Tboil | 426.53 | K | Relay (1.0) Calculated Property |
| Tc | 602.29 | K | Relay (1.0) Calculated Property |
| Tfus | 293.14 | K | Relay (1.0) Calculated Property |
| Vc | 0.630 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to trans-Di-tert-butylhyponitrite.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
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