5-Bromo-2-ethyl-6-fluoro-1-isopropylbenzimidazole - CAS 1352318-52-5
Catalog: |
BB061926 |
Product Name: |
5-Bromo-2-ethyl-6-fluoro-1-isopropylbenzimidazole |
CAS: |
1352318-52-5 |
Synonyms: |
5-Bromo-2-ethyl-6-fluoro-1-isopropylbenzimidazole; 5-bromo-2-ethyl-6-fluoro-1-propan-2-ylbenzimidazole; 5-Bromo-2-ethyl-6-fluoro-1-isopropyl-1,3-benzodiazole |
IUPAC Name: | 5-bromo-2-ethyl-6-fluoro-1-propan-2-ylbenzimidazole |
Description: | 5-Bromo-2-ethyl-6-fluoro-1-isopropylbenzimidazole |
Molecular Weight: | 285.16 |
Molecular Formula: | C12H14BrFN2 |
Canonical SMILES: | CCC1=NC2=CC(=C(C=C2N1C(C)C)F)Br |
InChI: | InChI=1S/C12H14BrFN2/c1-4-12-15-10-5-8(13)9(14)6-11(10)16(12)7(2)3/h5-7H,4H2,1-3H3 |
InChI Key: | URUOMJUOYMIMRN-UHFFFAOYSA-N |
Complexity: | 249 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 284.03244 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 284.03244 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 17.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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