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| CAS No.: | 32718-18-6 |
|---|---|
| Name: | BCDMH |
| Molecular Structure: | |
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| Formula: | C5H6BrClN2O2 |
| Molecular Weight: | 241.47 |
| Synonyms: | Hydantoin,1-bromo-3-chloro-5,5-dimethyl- (7CI,8CI);Aquabrome;BromiCide;Bromochloro-5,5-dimethylhydantoin;Ebasani 4400;Halogene T30;N-Bromo-N'-chloro-5,5-dimethylhydantoin;N-Monobromo-N-monochloro-5,5-dimethylhydantoin;Photobrome;Slimicide78P;1-Bromo-3-chloro-5,5-dimethylhydantoin; |
| EINECS: | 240-230-0 |
| Density: | 1.738 g/cm3 |
| Melting Point: | 159-163 °C |
| Boiling Point: | 232.7 °C at 760 mmHg |
| Flash Point: | 94.5 °C |
| Appearance: | white |
| Hazard Symbols: |
 O,  C
|
| Risk Codes: | 8-31-34 |
| Safety: | 8-17-26-36/37/39-41-45 |
| Transport Information: | UN 3085 5.1/PG 2 |
| PSA: | 21.70000 |
| LogP: | 2.98780 |
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Specification
The Bromochloro-5,5-dimethylimidazolidine-2,4-dione, with the CAS registry number 32718-18-6, has the systematic name 1-bromo-3-chloro-5,5-dimethylimidazolidine-2,4-dione. Its molecular formula is C5H6BrClN2O2 and its molecular weight is 241.47. It is used as a deodorizer and cleaner for automatic toilet bowl.
Other characteristics of the Bromochloro-5,5-dimethylimidazolidine-2,4-dione can be summarised as followings: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.52; (4)ACD/LogD (pH 7.4): 1.52; (5)ACD/BCF (pH 5.5): 8.42; (6)ACD/BCF (pH 7.4): 8.42; (7)ACD/KOC (pH 5.5): 159.96; (8)ACD/KOC (pH 7.4): 159.96; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 40.62 Å2; (13)Index of Refraction: 1.61; (14)Molar Refractivity: 43.71 cm3; (15)Molar Volume: 125.9 cm3; (16)Polarizability: 17.32×10-24cm3; (17)Surface Tension: 60.8 dyne/cm; (18)Density: 1.91 g/cm3; (19)Flash Point: 94.5 °C; (20)Enthalpy of Vaporization: 46.94 kJ/mol; (21)Boiling Point: 232.7 °C at 760 mmHg; (22)Vapour Pressure: 0.0583 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following: This chemical is causes burns. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
1.SMILES: O=C1N(Cl)C(=O)N(Br)C1(C)C
2.InChI: InChI=1/C5H6BrClN2O2/c1-5(2)3(10)8(7)4(11)9(5)6/h1-2H3
3.InChIKey: PIEXCQIOSMOEOU-UHFFFAOYAF