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CAS No.: | 60523-73-1 |
---|---|
Name: | Bromodichloroacetonitrile |
Article Data: | 1 |
Molecular Structure: | |
Formula: | C2BrCl2N |
Molecular Weight: | 188.839 |
Synonyms: | Acetonitrile,bromodichloro- (9CI);Bromodichloroacetonitrile; |
Density: | 2.076g/cm3 |
Boiling Point: | 108.7°C at 760 mmHg |
Flash Point: | 19.5°C |
PSA: | 23.79000 |
LogP: | 2.03628 |
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The Bromodichloroacetonitrile, its cas register number is 60523-73-1. It also can be called as Acetonitrile,2-bromo-2,2-dichloro- and the IUPAC name about this chemical is 2-bromo-2,2-dichloroacetonitrile.
Physical properties about are: (1)XLogP3-AA: 2; (2)Exact Mass: 186.859117; (3)MonoIsotopic Mass: 186.859117; (4)Topological Polar Surface Area: 23.8; (5)Heavy Atom Count: 6; (6)Complexity: 91; (7)Covalently-Bonded Unit Count: 1
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C(#N)C(Cl)(Cl)Br
(2)InChI: InChI=1S/C2BrCl2N/c3-2(4,5)1-6
(3)InChIKey: XDJVVCPVQOCPJI-UHFFFAOYSA-N