5'-Bromo-2'-hydroxy-2-phenylacetophenone - CAS 54981-34-9
Catalog: |
BB028877 |
Product Name: |
5'-Bromo-2'-hydroxy-2-phenylacetophenone |
CAS: |
54981-34-9 |
Synonyms: |
1-(5-bromo-2-hydroxyphenyl)-2-phenylethanone; 1-(5-bromo-2-hydroxyphenyl)-2-phenylethanone |
IUPAC Name: | 1-(5-bromo-2-hydroxyphenyl)-2-phenylethanone |
Description: | 5'-Bromo-2'-hydroxy-2-phenylacetophenone (CAS# 54981-34-9) is a useful research chemical. |
Molecular Weight: | 291.14 |
Molecular Formula: | C14H11BrO2 |
Canonical SMILES: | C1=CC=C(C=C1)CC(=O)C2=C(C=CC(=C2)Br)O |
InChI: | InChI=1S/C14H11BrO2/c15-11-6-7-13(16)12(9-11)14(17)8-10-4-2-1-3-5-10/h1-7,9,16H,8H2 |
InChI Key: | GVURCXUQMQBAFD-UHFFFAOYSA-N |
LogP: | 3.58010 |
Publication Number | Title | Priority Date |
AU-2010316780-A1 | Novel benzopyran kinase modulators | 20091105 |
AU-2010316780-B2 | Novel benzopyran kinase modulators | 20091105 |
AU-2015243070-A1 | Novel kinase modulators | 20091105 |
CA-2779574-A1 | Novel kinase modulators | 20091105 |
EP-2496567-B1 | Novel benzopyran kinase modulators | 20091105 |
Complexity: | 261 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 289.99424 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 289.99424 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.1 |
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