2-Chloro-6-methoxyphenylboronic acid

C₇H₈BClO₃CAS 385370-80-9186.40 g/mol

Open in Covalent MOL file

Aryl halide Boronic acid Ether

Properties

Molecular formula: C₇H₈BClO₃
Molar mass: 186.40 g/mol
Exact mass: 186.0255 Da
logP: 0.03Crippen estimate
Polar surface area: 49.7 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

385370-80-9

SMILES

B(C1=C(C=CC=C1Cl)OC)(O)O

InChIKey

XNWCIDBPLDKKAG-UHFFFAOYSA-N

InChI

InChI=1S/C7H8BClO3/c1-12-6-4-2-3-5(9)7(6)8(10)11/h2-4,10-11H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 2-Chloro-6-methoxyphenylboronic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

2,6-Dimethoxyphenylboronic acid23112-96-175 % similar 2-Fluoro-6-methoxyphenylboronic acid78495-63-362 % similar 2,6-Dichlorobenzeneboronic acid73852-17-261 % similar 2-Chloroanisole766-51-857 % similar 2,3-Dichloroanisole1984-59-453 % similar 2,4,6-Trimethoxyphenylboronic acid135159-25-052 % similar 1-Chloro-3-methoxy-2-methylbenzene3260-88-652 % similar 2-Methoxyphenylboronic acid5720-06-952 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Chloro-4-methoxybenzeneboronic acid175883-60-0 2-Chloro-4-methoxyphenylboronic acid219735-99-6 4-Chloro-2-methoxyphenylboronic acid762287-57-0 (2-Chloro-5-methoxyphenyl)boronic acid89694-46-2 B-(4-Chloro-3-methoxyphenyl)boronic acid89694-47-3 5-Chloro-2-methoxyphenylboronic acid89694-48-4 B-(3-Chloro-5-methoxyphenyl)boronic acid915201-07-9

Elsewhere

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