3,5-Difluoro-4-methoxyphenylboronic Acid - CAS 208641-98-9
Catalog: |
BB016358 |
Product Name: |
3,5-Difluoro-4-methoxyphenylboronic Acid |
CAS: |
208641-98-9 |
Synonyms: |
(3,5-difluoro-4-methoxyphenyl)boronic acid; (3,5-difluoro-4-methoxyphenyl)boronic acid |
IUPAC Name: | (3,5-difluoro-4-methoxyphenyl)boronic acid |
Description: | 3,5-Difluoro-4-methoxyphenylboronic Acid (CAS# 208641-98-9) is a useful research chemical. |
Molecular Weight: | 187.94 |
Molecular Formula: | C7H7F2O3B |
Canonical SMILES: | B(C1=CC(=C(C(=C1)F)OC)F)(O)O |
InChI: | InChI=1S/C7H7BF2O3/c1-13-7-5(9)2-4(8(11)12)3-6(7)10/h2-3,11-12H,1H3 |
InChI Key: | JJRIEFCRGWHLES-UHFFFAOYSA-N |
Appearance: | Powder |
MDL: | MFCD08706257 |
LogP: | -0.34680 |
Publication Number | Title | Priority Date |
US-2020102311-A1 | Monoacylglycerol Lipase Modulators | 20180928 |
WO-2020065614-A1 | Monoacylglycerol lipase modulators | 20180928 |
EP-3856179-A1 | Monoacylglycerol lipase modulators | 20180928 |
KR-20210069079-A | monoacylglycerol lipase modulator | 20180928 |
CN-111148735-A | Nitrogen-containing heteroaryl compounds and pharmaceutical uses thereof | 20171004 |
Complexity: | 158 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 188.0456306 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 188.0456306 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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