4-Chloro-2,3-difluorobromobenzene - CAS 1000574-47-9
Catalog: |
BB055520 |
Product Name: |
4-Chloro-2,3-difluorobromobenzene |
CAS: |
1000574-47-9 |
Synonyms: |
1-Bromo-4-chloro-2,3-difluorobenzene |
IUPAC Name: | 1-bromo-4-chloro-2,3-difluorobenzene |
Description: | 4-Chloro-2,3-difluorobromobenzene is used in preparation of heterocyclic compound for organic light-emitting device. |
Molecular Weight: | 227.43 |
Molecular Formula: | C6H2BrClF2 |
Canonical SMILES: | C1=CC(=C(C(=C1Cl)F)F)Br |
InChI: | InChI=1S/C6H2BrClF2/c7-3-1-2-4(8)6(10)5(3)9/h1-2H |
InChI Key: | NLNGUQIWICXNKO-UHFFFAOYSA-N |
References: | Yoon, J., et al. Repub. Korean Kongkae Taeho Kongbo, (2020). |
Complexity: | 122 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 225.89965 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 225.89965 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.4 |
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