1-Acetyl-3-bromo-6-fluoroindole - CAS 1375064-49-5
Catalog: |
BB008590 |
Product Name: |
1-Acetyl-3-bromo-6-fluoroindole |
CAS: |
1375064-49-5 |
Synonyms: |
1-(3-bromo-6-fluoro-1-indolyl)ethanone; 1-(3-bromo-6-fluoroindol-1-yl)ethanone |
IUPAC Name: | 1-(3-bromo-6-fluoroindol-1-yl)ethanone |
Description: | 1-Acetyl-3-bromo-6-fluoroindole (CAS# 1375064-49-5 ) is a useful research chemical. |
Molecular Weight: | 256.07 |
Molecular Formula: | C10H7BrFNO |
Canonical SMILES: | CC(=O)N1C=C(C2=C1C=C(C=C2)F)Br |
InChI: | InChI=1S/C10H7BrFNO/c1-6(14)13-5-9(11)8-3-2-7(12)4-10(8)13/h2-5H,1H3 |
InChI Key: | YOLRTVMJHOUEBW-UHFFFAOYSA-N |
LogP: | 4.21010 |
Complexity: | 248 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 254.9695 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 254.9695 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 22 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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