1-(4-Bromo-2-fluorophenyl)cyclobutanecarboxylic Acid - CAS 1314788-41-4
Catalog: |
BB007417 |
Product Name: |
1-(4-Bromo-2-fluorophenyl)cyclobutanecarboxylic Acid |
CAS: |
1314788-41-4 |
Synonyms: |
1-(4-bromo-2-fluorophenyl)-1-cyclobutanecarboxylic acid; 1-(4-bromo-2-fluorophenyl)cyclobutane-1-carboxylic acid |
IUPAC Name: | 1-(4-bromo-2-fluorophenyl)cyclobutane-1-carboxylic acid |
Description: | 1-(4-Bromo-2-fluorophenyl)cyclobutanecarboxylic Acid (CAS# 1314788-41-4 ) is a useful research chemical. |
Molecular Weight: | 273.10 |
Molecular Formula: | C11H10BrFO2 |
Canonical SMILES: | C1CC(C1)(C2=C(C=C(C=C2)Br)F)C(=O)O |
InChI: | InChI=1S/C11H10BrFO2/c12-7-2-3-8(9(13)6-7)11(10(14)15)4-1-5-11/h2-3,6H,1,4-5H2,(H,14,15) |
InChI Key: | XVYLKNMPDDHROU-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
AU-2018265615-A1 | Substituted heterocyclic compounds as allosteric modulators of group II metabotropic glutamate receptors | 20170512 |
BR-112019019740-A2 | substituted heterocyclic compounds as allosteric modulators of group II metabotropic glutamate receptors | 20170512 |
CN-110769830-A | Substituted heterocyclic compounds as allosteric modulators of group II metabotropic glutamate receptors | 20170512 |
EP-3621620-A1 | Substituted heterocyclic compounds as allosteric modulators of group ii metabotropic glutamate receptors | 20170512 |
KR-20200035234-A | Substituted heterocyclic compounds as allosteric modulators of Group II metabolic glutamate receptors | 20170512 |
Complexity: | 265 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 271.98482 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 271.98482 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 37.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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