- InChI
- InChI=1S/C6H10Cl2N4O3/c7-1-3-9-5(13)10-6(14)12(11-15)4-2-8/h1-4H2,(H2,9,10,13,14)
- InChI Key
- KEUPEGWEPJSQDJ-UHFFFAOYSA-N
- Formula
- C6H10Cl2N4O3
- SMILES
- O=NN(CCCl)C(O)=NC(O)=NCCCl
- Molecular Weight1
- 257.07
- CAS
- 13857-12-0
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 1.0575 | Relay (1.0) Calculated Property | |
| ΔfG° | 77.97 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -387.57 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 110.44 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.75 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.39 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.275 | Crippen Calculated Property | |
| McVol | 164.510 | ml/mol | McGowan Calculated Property |
| Pc | 2758.46 | kPa | Joback Calculated Property |
| Tboil | 566.67 | K | Relay (1.0) Calculated Property |
| Tc | 874.67 | K | Relay (1.0) Calculated Property |
| Tfus | 406.53 | K | Relay (1.0) Calculated Property |
| Vc | 0.582 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to Biuret, 1,5-bis(2-chloroethyl)-1-nitroso-.
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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