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| CAS No.: | 15414-82-1 |
|---|---|
| Name: | 5-Ethylhydantoin |
| Molecular Structure: | |
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|
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| Formula: | C5H8N2O2 |
| Molecular Weight: | 128.13 |
| Synonyms: | Hydantoin, 5-ethyl- (6CI,8CI);5-Ethylhydantoin;5-Ethylimidazolidine-2,4-dione;5-Ethylimidazoline-2,4-dione;Ethylhydantoin;NSC 75832; |
| Density: | 1.15 g/cm3 |
| Melting Point: | 120 °C |
| Boiling Point: | 363.64°C (rough estimate) |
| Solubility: | 110.6g/L(temperature not stated) |
| Hazard Symbols: |
 Xi, C
|
| Risk Codes: | R34 |
| PSA: | 58.20000 |
| LogP: | 0.26200 |
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Specification
The cas register number of 5-Ethylhydantoin is 15414-82-1. It also can be called as 2,4-Imidazolidinedione,5-ethyl- and the Systematic name about this chemical is 5-ethylimidazolidine-2,4-dione.
Physical properties about 5-Ethylhydantoin are: (1)ACD/LogP: -0.67; (2)ACD/LogD (pH 5.5): -0.67; (3)ACD/LogD (pH 7.4): -0.67; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 10.34; (7)ACD/KOC (pH 7.4): 10.26; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 40.62Å2; (12)Index of Refraction: 1.453; (13)Molar Refractivity: 30.11 cm3; (14)Molar Volume: 111.3 cm3; (15)Polarizability: 11.94x10-24cm3; (16)Surface Tension: 32.2 dyne/cm.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C1NC(=O)NC1CC
(2)InChI: InChI=1/C5H8N2O2/c1-2-3-4(8)7-5(9)6-3/h3H,2H2,1H3,(H2,6,7,8,9)
(3)InChIKey: RSBRXBZGVHQUJK-UHFFFAOYAS
(4)Std. InChI: InChI=1S/C5H8N2O2/c1-2-3-4(8)7-5(9)6-3/h3H,2H2,1H3,(H2,6,7,8,9)
(5)Std. InChIKey: RSBRXBZGVHQUJK-UHFFFAOYSA-N