- InChI
- InChI=1S/C5H6BrClN2O2/c1-5(2)3(10)8(7)4(11)9(5)6/h1-2H3
- InChI Key
- PIEXCQIOSMOEOU-UHFFFAOYSA-N
- Formula
- C5H6BrClN2O2
- SMILES
- CC1(C)C(=O)N(Cl)C(=O)N1Br
- Molecular Weight1
- 241.47
- CAS
- 16079-88-2
- Other Names
-
- 1-bromo-3-chloro-5,5-dimethylimidazolidine-2,4-dione
- 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 | 0.4722 | Relay (... Calculated Property | |
| ΔfG° | -45.87 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | -149.93 | kJ/mol | Relay (... Calculated Property |
| ΔvapH° | 61.64 | kJ/mol | Relay (... Calculated Property |
| IE | 9.18 | eV | Relay (... Calculated Property |
| log10WS | -2.70 | Relay (... Calculated Property | |
| logPoct/wat | 1.493 | Crippen Calculated Property | |
| McVol | 123.290 | ml/mol | McGowan Calculated Property |
| Pc | 3154.60 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 510.02 | K | Relay (... Calculated Property |
| Tc | 773.07 | K | Relay (... Calculated Property |
| Tfus | 426.98 | K | Relay (... Calculated Property |
| Vc | 0.456 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to 1-Bromo-3-chloro-5,5-dimethyl hydantoin.
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
- McGowan Method
- NIST Webbook
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