5-Chloro-2-ethoxyphenylboronic acid

C₈H₁₀BClO₃CAS 352534-86-2200.42 g/mol

Open in Covalent MOL file

Aryl halide Boronic acid Ether

Properties

Molecular formula: C₈H₁₀BClO₃
Molar mass: 200.42 g/mol
Exact mass: 200.0412 Da
logP: 0.42Crippen estimate
Polar surface area: 49.7 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 3

Identifiers

CAS number

352534-86-2

SMILES

CCOc1ccc(Cl)cc1B(O)O

InChIKey

OSMBQNBPCSSVMT-UHFFFAOYSA-N

InChI

InChI=1S/C8H10BClO3/c1-2-13-8-4-3-6(10)5-7(8)9(11)12/h3-5,11-12H,2H2,1H3

Weigh it out

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

Names and synonyms

4 names

Boronic acid, B-(5-chloro-2-ethoxyphenyl)-
Boronic acid, (5-chloro-2-ethoxyphenyl)-
B-(5-Chloro-2-ethoxyphenyl)boronic acid
2-Ethoxy-5-chlorophenylboronic acid

Work with 5-Chloro-2-ethoxyphenylboronic 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-Ethoxy-5-methylphenylboronic acid123291-97-465 % similar 5-Chloro-2-methoxyphenylboronic acid89694-48-464 % similar B-(4-Ethoxy-2,3-difluorophenyl)boronic acid212386-71-553 % similar 3-Ethoxy-2-fluorophenylboronic acid855230-61-451 % similar 1-Chloro-4-ethoxybenzene622-61-744 % similar B-(3-Ethoxy-2,6-difluorophenyl)boronic acid849062-00-644 % similar B-(3-Ethoxy-4-fluorophenyl)boronic acid900174-65-444 % similar Ethyl 2,4-dichlorophenoxyacetate533-23-343 % similar

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

Same formula

3-Chloro-4-ethoxyphenylboronic acid279261-81-3

Elsewhere

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