1,3-Dibromo-5-fluoro-4-methoxy-6-methyl-2-nitrobenzene - CAS 1357103-68-4
Catalog: |
BB008237 |
Product Name: |
1,3-Dibromo-5-fluoro-4-methoxy-6-methyl-2-nitrobenzene |
CAS: |
1357103-68-4 |
Synonyms: |
1,5-dibromo-3-fluoro-2-methoxy-4-methyl-6-nitrobenzene; 1,5-dibromo-3-fluoro-2-methoxy-4-methyl-6-nitrobenzene |
IUPAC Name: | 1,5-dibromo-3-fluoro-2-methoxy-4-methyl-6-nitrobenzene |
Description: | 1,3-Dibromo-5-fluoro-4-methoxy-6-methyl-2-nitrobenzene (CAS# 1357103-68-4 ) is a useful research chemical. |
Molecular Weight: | 342.94 |
Molecular Formula: | C8H6Br2FNO3 |
Canonical SMILES: | CC1=C(C(=C(C(=C1Br)[N+](=O)[O-])Br)OC)F |
InChI: | InChI=1S/C8H6Br2FNO3/c1-3-4(9)7(12(13)14)5(10)8(15-2)6(3)11/h1-2H3 |
InChI Key: | OYKBBTHPHANVED-UHFFFAOYSA-N |
LogP: | 4.09910 |
Publication Number | Title | Priority Date |
US-2018208594-A1 | Pyrrolopyrimidine itk inhibitors for treating inflammation and cancer | 20170125 |
AU-2011282742-A1 | Compositions and methods for inhibition of the JAK pathway | 20100728 |
AU-2011282742-A2 | Compositions and methods for inhibition of the JAK pathway | 20100728 |
AU-2011282742-B2 | Compositions and methods for inhibition of the JAK pathway | 20100728 |
AU-2015261604-A1 | Compositions and methods for inhibition of the JAK pathway | 20100728 |
Complexity: | 251 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 342.8678 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 340.86985 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 55 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.6 |
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