4-Bromo-2-(1-bromo-2,2,2-trifluoroethyl)-1-methoxybenzene - CAS 1250022-39-9
Catalog: |
BB071481 |
Product Name: |
4-Bromo-2-(1-bromo-2,2,2-trifluoroethyl)-1-methoxybenzene |
CAS: |
1250022-39-9 |
Synonyms: |
Benzene, 4-bromo-2-(1-bromo-2,2,2-trifluoroethyl)-1-methoxy-; 4-bromo-2-(1-bromo-2,2,2-trifluoroethyl)-1-methoxybenzene; 4-bromo-2-(1-bromo-2,2,2-trifluoroethyl)-1-methoxy-Benzene |
IUPAC Name: | 4-bromo-2-(1-bromo-2,2,2-trifluoroethyl)-1-methoxybenzene |
Molecular Weight: | 347.95 |
Molecular Formula: | C9H7Br2F3O |
Canonical SMILES: | COC1=C(C=C(C=C1)Br)C(C(F)(F)F)Br |
InChI: | InChI=1S/C9H7Br2F3O/c1-15-7-3-2-5(10)4-6(7)8(11)9(12,13)14/h2-4,8H,1H3 |
InChI Key: | OVURZWOXRAOROQ-UHFFFAOYSA-N |
Complexity: | 210 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 347.87953 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 345.88157 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.3 |
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