3-(Trifluoromethoxy)-4-(methylsulfonyl)bromobenzene - CAS 731018-69-2
Catalog: |
BB034769 |
Product Name: |
3-(Trifluoromethoxy)-4-(methylsulfonyl)bromobenzene |
CAS: |
731018-69-2 |
Synonyms: |
4-bromo-1-methylsulfonyl-2-(trifluoromethoxy)benzene; 4-bromo-1-methylsulfonyl-2-(trifluoromethoxy)benzene |
IUPAC Name: | 4-bromo-1-methylsulfonyl-2-(trifluoromethoxy)benzene |
Description: | 3-(Trifluoromethoxy)-4-(methylsulfonyl)bromobenzene (CAS# 731018-69-2) is a useful research chemical. |
Molecular Weight: | 319.10 |
Molecular Formula: | C8H6BrF3O3S |
Canonical SMILES: | CS(=O)(=O)C1=C(C=C(C=C1)Br)OC(F)(F)F |
InChI: | InChI=1S/C8H6BrF3O3S/c1-16(13,14)7-3-2-5(9)4-6(7)15-8(10,11)12/h2-4H,1H3 |
InChI Key: | BTIZYKDXEHWPSN-UHFFFAOYSA-N |
LogP: | 3.83200 |
Publication Number | Title | Priority Date |
WO-2013001297-A1 | Binding inhibitors of the beta.transducin repeat - containing protein | 20110627 |
US-2008226622-A1 | Hif Inhibitors | 20050825 |
US-8071795-B2 | HIF inhibitors | 20050825 |
CA-2509086-C | Substituted arylcyclopropylacetamides as glucokinase activators | 20030106 |
EP-1585739-A1 | Substituted arylcyclopropylacetamides as glucokinase activators | 20030106 |
Complexity: | 335 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 317.91731 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 317.91731 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 51.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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