3-Methoxybenzeneboronic Acid
Product Information
Molecular Formula
C7H9BO3
Molecular Weight
151.96
Description
3-Methoxybenzeneboronic Acid (CAS# 10365-98-7) is a phenylboronic acid used to investigate boron function in plants.
Synonyms
(3-methoxyphenyl)boronic acid; (3-methoxyphenyl)boronic acid
IUPAC Name
(3-methoxyphenyl)boronic acid
SMILES
B(C1=CC(=CC=C1)OC)(O)O
InChI
InChI=1S/C7H9BO3/c1-11-7-4-2-3-6(5-7)8(9)10/h2-5,9-10H,1H3
InChI Key
NLLGFYPSWCMUIV-UHFFFAOYSA-N
Boiling Point
318.6 °C at 760 mmHg
Melting Point
160-163 °C (lit.)
Flash Point
Not applicable
Density
1.17 g/cm3
Storage
Keep in dark place, Sealed in dry, Room Temperature
LogP
-0.62500
Safety Information
Precautionary Statement
P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
152.0644743 g/mol
Monoisotopic Mass
152.0644743 g/mol
Topological Polar Surface Area
49.7Ų
Heavy Atom Count
11
Formal Charge
0
Complexity
118
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114057678-A | Synthetic method of 1-bromo-3-chlorodibenzofuran | 2021-12-27 |
| CN-114163381-A | Method for synthesizing (2, 6-diphenylpyridine-3, 5-diacyl) bis (benzophenone) and derivatives thereof | 2021-12-01 |
| CN-114016060-A | Synthetic method of phenolic compound | 2021-11-23 |
| CN-114085184-A | Biphenyl derivative containing cyclopropane structure and preparation method and application thereof | 2021-11-17 |
| CN-113999229-A | Cage-shaped compound and application thereof | 2021-11-12 |
| CN-113929635-A | 1, 6-diphenyl-1H-benzo [ d ] [1,2,3] triazole compound and preparation method and application thereof | 2021-11-09 |
| CN-113979918-A | C-3-position five-membered spiro indolone derivative containing all-carbon tetra-substituted olefin structure and preparation and application thereof | 2021-11-04 |
| CN-113788846-A | Tricyclic thiazolo [5,4-d ] pyrimidone derivative and application thereof | 2021-10-27 |
| CN-113896701-A | Synthesis process of Hsp90 inhibitor KU-177 | 2021-10-20 |
| CN-113769776-A | Preparation method and application of USY molecular sieve supported reduction metal copper catalyst | 2021-09-28 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 18983140 | 2008-11-27 | Discovery of boronic acids as novel and potent inhibitors of fatty acid amide hydrolase | Journal of medicinal chemistry |
