3-Bromo-4-oxo-4-phenylbutanoic Acid - CAS 53515-22-3
Catalog: |
BB028254 |
Product Name: |
3-Bromo-4-oxo-4-phenylbutanoic Acid |
CAS: |
53515-22-3 |
Synonyms: |
3-bromo-4-oxo-4-phenylbutanoic acid; 3-bromo-4-oxo-4-phenylbutanoic acid |
IUPAC Name: | 3-bromo-4-oxo-4-phenylbutanoic acid |
Description: | 3-Bromo-4-oxo-4-phenylbutanoic Acid (CAS# 53515-22-3) is a useful research chemical. |
Molecular Weight: | 257.08 |
Molecular Formula: | C10H9BrO3 |
Canonical SMILES: | C1=CC=C(C=C1)C(=O)C(CC(=O)O)Br |
InChI: | InChI=1S/C10H9BrO3/c11-8(6-9(12)13)10(14)7-4-2-1-3-5-7/h1-5,8H,6H2,(H,12,13) |
InChI Key: | VPUHMOLSUUYGEJ-UHFFFAOYSA-N |
Boiling Point: | 371.2 °C at 760 mmHg |
Density: | 1.585 g/cm3 |
LogP: | 2.10750 |
Publication Number | Title | Priority Date |
EP-2586780-B1 | 2-aryl imidazo[1,2-a]pyridine-3-acetamide derivatives, preparation methods and use thereof | 20100625 |
US-2013203754-A1 | 2-Aryl Imidazo[1,2-a]Pyridine-3-Acetamide Derivatives, Preparation Methods and Uses Thereof | 20100625 |
US-8980887-B2 | 2-aryl imidazo[1,2-a]pyridine-3-acetamide derivatives, preparation methods and uses thereof | 20100625 |
WO-2011160548-A1 | 2-aryl imidazo[1,2-a]pyridine-3-acetamide derivatives, preparation methods and use thereof | 20100625 |
WO-2006085815-A1 | Thiazole derivatives, their process for their preparation and their use in therapy | 20050211 |
Complexity: | 221 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 255.97351 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 255.97351 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 54.4 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.9 |
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