1-Bromo-3-(chloromethyl)-5-fluorobenzene - CAS 1094651-50-9
Catalog: |
BB072157 |
Product Name: |
1-Bromo-3-(chloromethyl)-5-fluorobenzene |
CAS: |
1094651-50-9 |
Synonyms: |
3-BROMO-5-FLUOROBENZYL CHLORIDE; 1-BROMO-3-(CHLOROMETHYL)-5-FLUOROBENZENE |
IUPAC Name: | 1-bromo-3-(chloromethyl)-5-fluorobenzene |
Description: | 1-Bromo-3-(chloromethyl)-5-fluorobenzene |
Molecular Weight: | 223.47 |
Molecular Formula: | C7H5BrClF |
Canonical SMILES: | C1=C(C=C(C=C1F)Br)CCl |
InChI: | InChI=1S/C7H5BrClF/c8-6-1-5(4-9)2-7(10)3-6/h1-3H,4H2 |
InChI Key: | QNVSLUFLTUOQNT-UHFFFAOYSA-N |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 221.92472 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 221.92472 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 0Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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