4'-Chloro-2-(2,4-dichlorophenyl)acetophenone - CAS 654682-18-5
Catalog: |
BB032741 |
Product Name: |
4'-Chloro-2-(2,4-dichlorophenyl)acetophenone |
CAS: |
654682-18-5 |
Synonyms: |
1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)ethanone; 1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)ethanone |
IUPAC Name: | 1-(4-chlorophenyl)-2-(2,4-dichlorophenyl)ethanone |
Description: | 4'-Chloro-2-(2,4-dichlorophenyl)acetophenone (CAS# 654682-18-5) is a useful research chemical. |
Molecular Weight: | 299.58 |
Molecular Formula: | C14H9Cl3O |
Canonical SMILES: | C1=CC(=CC=C1C(=O)CC2=C(C=C(C=C2)Cl)Cl)Cl |
InChI: | InChI=1S/C14H9Cl3O/c15-11-4-1-9(2-5-11)14(18)7-10-3-6-12(16)8-13(10)17/h1-6,8H,7H2 |
InChI Key: | QKJIFHFYZXQGIA-UHFFFAOYSA-N |
LogP: | 5.07220 |
Publication Number | Title | Priority Date |
EP-1966173-A2 | Heterocyclic derivatives, preparation and therapeutic use thereof | 20051212 |
FR-2894578-A1 | HETEROCYCLIC DERIVATIVES, THEIR PREPARATION AND THEIR THERAPEUTIC USE. | 20051212 |
JP-2009518453-A | Heterocyclic derivatives, their preparation and therapeutic use | 20051212 |
US-2008269303-A1 | Heterocyclic derivatives, preparation and therapeutic use thereof | 20051212 |
US-7618991-B2 | Heterocyclic derivatives, preparation and therapeutic use thereof | 20051212 |
Complexity: | 287 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 297.971898 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 297.971898 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 17.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.1 |
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