| Canonical Smiles | C(=C(Cl)Br)(F)F |
|---|---|
| IUPAC Name | 1-bromo-1-chloro-2,2-difluoroethene |
| InChIKey | NBYWEYFBDHRDOS-UHFFFAOYSA-N |
| INCHI | 1S/C2BrClF2/c3-1(4)2(5)6 |
| Isomeric SMILES | C(=C(Cl)Br)(F)F |
| PubChem CID | 12963 |
| Molecular Weight | 177.38 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organohalogen compounds |
| Class | Vinyl halides |
| Subclass | Vinyl fluorides |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Vinyl fluorides |
| Alternative Parents | Vinyl chlorides Vinyl bromides Fluoroalkenes Chloroalkenes Bromoalkenes Organofluorides Organochlorides Organobromides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Fluoroalkene - Chloroalkene - Bromoalkene - Haloalkene - Vinyl fluoride - Vinyl chloride - Vinyl bromide - Hydrocarbon derivative - Organofluoride - Organochloride - Organobromide - Aliphatic acyclic compound |
| Description | This compound belongs to the class of organic compounds known as vinyl fluorides. These are vinyl halides in which a fluorine atom is bonded to an sp2-hybridised carbon atom. |
| External Descriptors | Not available |
| Molecular Weight | 177.370 g/mol |
|---|---|
| XLogP3 | 2.400 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 0 |
| Exact Mass | 175.884 Da |
| Monoisotopic Mass | 175.884 Da |
| Topological Polar Surface Area | 0.000 Ų |
| Heavy Atom Count | 6 |
| Formal Charge | 0 |
| Complexity | 75.600 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
