1-Bromo-2,4-difluoro-3-methoxybenzene - CAS 221221-00-7
Catalog: |
BB073439 |
Product Name: |
1-Bromo-2,4-difluoro-3-methoxybenzene |
CAS: |
221221-00-7 |
Synonyms: |
1-BROMO-2,4-DIFLUORO-3-METHOXYBENZENE; 3-bromo-2,6-difluoroanisole; 3-Methoxy-2,4-difluoro-bromobenzene |
IUPAC Name: | 1-bromo-2,4-difluoro-3-methoxybenzene |
Description: | 1-Bromo-2,4-difluoro-3-methoxybenzene (cas# 221221-00-7) is a useful research chemical. |
Molecular Weight: | 223.01 |
Molecular Formula: | C7H5OF2Br |
Canonical SMILES: | COC1=C(C=CC(=C1F)Br)F |
InChI: | InChI=1S/C7H5BrF2O/c1-11-7-5(9)3-2-4(8)6(7)10/h2-3H,1H3 |
InChI Key: | RXNZFRZJZNMBBJ-UHFFFAOYSA-N |
Complexity: | 134 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.94918 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.94918 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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