4-(Difluoromethoxy)-3-fluorophenylboronic Acid - CAS 958451-69-9
Catalog: |
BB041860 |
Product Name: |
4-(Difluoromethoxy)-3-fluorophenylboronic Acid |
CAS: |
958451-69-9 |
Synonyms: |
[4-(difluoromethoxy)-3-fluorophenyl]boronic acid; [4-(difluoromethoxy)-3-fluorophenyl]boronic acid |
IUPAC Name: | [4-(difluoromethoxy)-3-fluorophenyl]boronic acid |
Description: | 4-(Difluoromethoxy)-3-fluorophenylboronic Acid (CAS# 958451-69-9 ) is a useful research chemical. |
Molecular Weight: | 205.93 |
Molecular Formula: | C7H6F3O3B |
Canonical SMILES: | B(C1=CC(=C(C=C1)OC(F)F)F)(O)O |
InChI: | InChI=1S/C7H6BF3O3/c9-5-3-4(8(12)13)1-2-6(5)14-7(10)11/h1-3,7,12-13H |
InChI Key: | GLEIDCGEZNIJBD-UHFFFAOYSA-N |
LogP: | 0.10690 |
Publication Number | Title | Priority Date |
US-2020102303-A1 | Monoacylglycerol Lipase Modulators | 20180928 |
WO-2020065613-A1 | Monoacylglycerol lipase modulators | 20180928 |
TW-202028198-A | Monoacylglycerol lipase modulators | 20180928 |
EP-3856178-A1 | Monoacylglycerol lipase modulators | 20180928 |
KR-20210069080-A | monoacylglycerol lipase modulator | 20180928 |
Complexity: | 182 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 206.0362087 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 206.0362087 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 49.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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