4-Bromo-2-(trifluoromethoxy)benzoic Acid - CAS 509142-48-7
Catalog: |
BB027267 |
Product Name: |
4-Bromo-2-(trifluoromethoxy)benzoic Acid |
CAS: |
509142-48-7 |
Synonyms: |
4-bromo-2-(trifluoromethoxy)benzoic acid; 4-bromo-2-(trifluoromethoxy)benzoic acid |
IUPAC Name: | 4-bromo-2-(trifluoromethoxy)benzoic acid |
Description: | 4-Bromo-2-(trifluoromethoxy)benzoic Acid (CAS# 509142-48-7) is a useful research chemical. |
Molecular Weight: | 285.01 |
Molecular Formula: | C8H4BrF3O3 |
Canonical SMILES: | C1=CC(=C(C=C1Br)OC(F)(F)F)C(=O)O |
InChI: | InChI=1S/C8H4BrF3O3/c9-4-1-2-5(7(13)14)6(3-4)15-8(10,11)12/h1-3H,(H,13,14) |
InChI Key: | LMFGPGVCUFRLQC-UHFFFAOYSA-N |
Boiling Point: | 272.7 °C at 760 mmHg |
Density: | 1.797 g/cm3 |
MDL: | MFCD12546979 |
LogP: | 3.04590 |
Publication Number | Title | Priority Date |
WO-2021191359-A1 | Monoacylglycerol lipase modulators | 20200326 |
WO-2021178920-A1 | Compounds for targeted degradation of brd9 | 20200305 |
WO-2021028382-A1 | [1,2,4]triazolo[1,5-c]quinazolin-5-amines | 20190812 |
US-2019382349-A1 | PHENYL SUBSTITUTED PYRAZOLES AS MODULATORS OF RORgT | 20180618 |
WO-2019243999-A1 | Phenyl substituted pyrazoles as modulators of roryt | 20180618 |
Complexity: | 244 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 283.92959 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 283.92959 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 46.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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