3'-Bromo-4'-(1-imidazolyl)acetophenone - CAS 1141669-55-7
Catalog: |
BB003309 |
Product Name: |
3'-Bromo-4'-(1-imidazolyl)acetophenone |
CAS: |
1141669-55-7 |
Synonyms: |
1-[3-bromo-4-(1-imidazolyl)phenyl]ethanone; 1-(3-bromo-4-imidazol-1-ylphenyl)ethanone |
IUPAC Name: | 1-(3-bromo-4-imidazol-1-ylphenyl)ethanone |
Description: | 3'-Bromo-4'-(1-imidazolyl)acetophenone (CAS# 1141669-55-7) is a useful research chemical. |
Molecular Weight: | 265.11 |
Molecular Formula: | C11H9BrN2O |
Canonical SMILES: | CC(=O)C1=CC(=C(C=C1)N2C=CN=C2)Br |
InChI: | InChI=1S/C11H9BrN2O/c1-8(15)9-2-3-11(10(12)6-9)14-5-4-13-7-14/h2-7H,1H3 |
InChI Key: | YXCHZUPKBMZDGO-UHFFFAOYSA-N |
LogP: | 2.83740 |
Complexity: | 247 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 263.98983 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 263.98983 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 34.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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