4-(Methoxycarbonyl)-2-methylphenylboronic Acid - CAS 158429-38-0
Catalog: |
BB011415 |
Product Name: |
4-(Methoxycarbonyl)-2-methylphenylboronic Acid |
CAS: |
158429-38-0 |
Synonyms: |
(4-methoxycarbonyl-2-methylphenyl)boronic acid; (4-methoxycarbonyl-2-methylphenyl)boronic acid |
IUPAC Name: | (4-methoxycarbonyl-2-methylphenyl)boronic acid |
Description: | 4-(Methoxycarbonyl)-2-methylphenylboronic Acid (CAS# 158429-38-0) is a useful research chemical. |
Molecular Weight: | 193.99 |
Molecular Formula: | C9H11O4B |
Canonical SMILES: | B(C1=C(C=C(C=C1)C(=O)OC)C)(O)O |
InChI: | InChI=1S/C9H11BO4/c1-6-5-7(9(11)14-2)3-4-8(6)10(12)13/h3-5,12-13H,1-2H3 |
InChI Key: | MOBGLFACQCDFEQ-UHFFFAOYSA-N |
LogP: | -0.53860 |
Publication Number | Title | Priority Date |
JP-2021143175-A | Pharmaceutical composition containing an imidazolipyridinone compound | 20200312 |
JP-2021143176-A | Method for Producing Imidazopyridinone Compound | 20200312 |
WO-2020054788-A1 | Imidazopyridinone compound | 20180913 |
TW-202024077-A | Imidazopyridinone compound | 20180913 |
CN-112689637-A | Imidazopyridinone compounds | 20180913 |
Complexity: | 207 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.075039 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.075039 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 66.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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