(4-Methoxyphenyl)boronic acid

HCID 201262CAS 5720-07-0
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1ccc(B(O)O)cc1
InChIKey
VOAAEKKFGLPLLU-UHFFFAOYSA-N
Molecular formula
C7H9BO3
Average molar mass
151.96 g/mol
Monoisotopic mass
152.06447455

Overview

structure in first source

Names & identifiers

Preferred name
(4-Methoxyphenyl)boronic acid
IUPAC
(4-methoxyphenyl)boronic acid
English name
4-Methoxyphenylboronic acid
Molecular formula
C7H9BO3
Molecular weight
151.96

Names & synonyms

4-Methoxyphenylboronic acid5720-07-0(4-Methoxyphenyl)boronic acidBenzeneboronic acid, p-methoxy-DTXSID60205837RefChem:562987DTXCID90128328611-482-24-Methoxybenzeneboronic acidp-Methoxyphenylboronic acidp-Anisylboronic acidp-Methoxybenzeneboronic acid
Show more names
AKOS 91312AKOS BRN-00164-boronoanisoleBIO-FARMA BF000847TIMTEC-BB SBB004055RARECHEM AH PB 0191
MFCD000391394-methoxyphenylboronicacid4-Methoxyphenyl boronic acidBoronic acid, p-methoxyphenyl-BORONIC ACID, (4-METHOXYPHENYL)-4-methoxylphenylboronic acid4methoxyphenylboronic acid4-methoxy-phenylboronic acid

Database identifiers

CAS
5720-07-0
PubChem CID
201262
DTXSID
DTXSID60205837
ChEMBL
CHEMBL21427
EC Number
611-482-2
Nikkaji
J54.864B

Properties

Computed structural properties

Topological polar surface area
49.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
11

Physicochemical properties

Melting point
204 · 204-206 °C(lit.)
Boiling point
306.8 · 306.8±44.0 °C(Predicted)
Density
1.17 · 1.17±0.1 g/cm3(Predicted)
storage temp.
Keep in dark place,Sealed in dry,Room Temperature
solubility
Soluble in dimethyl sulfoxide and methanol.
form
Crystalline Powder

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (98.1%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 53 reports by companies from 13 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesSkin Irrit. 2 (98.1%)

Safety data

PPE
dust mask type N95 (US), Eyeshields, Gloves
wgk
3
tsca
No
rtecs
CY8975000
hs_code
29310095
risk_code
36/37/38

Chemistry & industry

Applications · 4 items

Uses4-Methoxyphenylboronic acid can be used as a common organic reagent in Suzuki coupling reactions to study the N-arylation of imidazoles and amines catalyzed by copper exchange of calcium fluorophosphates.Reagent used in the preparation of various biological inhibitors.

Uses4-Methoxyphenylboronic acid is a reagent used forSuzuki-Miyaura cross-coupling reactionsPd-catalyzed direct arylationHighly effective synthesis using palladium-catalyzed arylation Suzuki-Miyaura cross-coupling in waterPalladium-catalyzed stereoselective Heck-type reactionTandem-type Pd(II)-catalyzed oxidative Heck reaction and intramolecular C-H amidation sequenceCopper-mediated ligandless aerobic fluoroalkylation of arylboronic acids with fluoroalkyl iodides Ruthenium catalyzed direct arylationRh-catalyzed asymmetric conjugate addition

Uses4-Methoxylphenylboronic Acid is a phenylboronic acid used to investigate boron function in plants.

Usessuzuki reaction

Upstream & downstream products

Suppliers50 total

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
INTATRADE GmbH+49 3493/605464 · [email protected]

Related reactions

7,951 records
New reaction record

Linked notes

Loading…