2,5-Dibromo-1,3-difluorobenzene - CAS 128259-71-2
Catalog: |
BB068154 |
Product Name: |
2,5-Dibromo-1,3-difluorobenzene |
CAS: |
128259-71-2 |
Synonyms: |
2,5-dibromo-1,3-difluorobenzene; 1,4-Dibromo-3,5-difluorobenzene; Benzene, 2,5-dibromo-1,3-difluoro-; 2,5-Dibromo-1,3-difluoro-benzene |
IUPAC Name: | 2,5-dibromo-1,3-difluorobenzene |
Description: | 2,5-Dibromo-1,3-difluorobenzene is used in the preparation of bicyclohexylylacetylene and bicyclohexyl-containing diyne liquid crystal compounds. |
Molecular Weight: | 271.88 |
Molecular Formula: | C6H2Br2F2 |
Canonical SMILES: | C1=C(C=C(C(=C1F)Br)F)Br |
InChI: | InChI=1S/C6H2Br2F2/c7-3-1-4(9)6(8)5(10)2-3/h1-2H |
InChI Key: | OCUXAWVQPORIBP-UHFFFAOYSA-N |
References: | Li, S., et al. Yejing Yu Xianshi, 22, 1 (2007). |
GHS Hazard Statement: | H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, and P501 |
Signal Word: | Warning |
Complexity: | 108 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 271.84708 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 269.84913 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.5 |
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