chempirical

3-Methoxynaphthalene-2-boronic acid

C11H11BO3CAS 104115-76-6202.02 g/mol

Open in Covalent MOL file
BOHOHO
Boronic acidEther

Properties

Molecular formula
C11H11BO3
Molar mass
202.02 g/mol
Exact mass
202.0801 Da
logP
0.53Crippen estimate
Polar surface area
49.7 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Identifiers

CAS number
104115-76-6
SMILES
B(C1=CC2=CC=CC=C2C=C1OC)(O)O
InChIKey
RHNSMLZROCLQBJ-UHFFFAOYSA-N
InChI
InChI=1S/C11H11BO3/c1-15-11-7-9-5-3-2-4-8(9)6-10(11)12(13)14/h2-7,13-14H,1H3

Weigh it out

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

Work with 3-Methoxynaphthalene-2-boronic 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-Methoxyphenylboronic acid5720-06-961 % similar 2,5-Dimethoxyphenylboronic acid107099-99-056 % similar 2-Methoxy-5-methylphenylboronic acid127972-00-354 % similar 5-Fluoro-2-methoxyphenylboronic acid179897-94-053 % similar 5-Bromo-2-methoxyphenylboronic acid89694-45-153 % similar 5-Chloro-2-methoxyphenylboronic acid89694-48-453 % similar 3,4-Dimethoxyphenylboronic acid122775-35-350 % similar 2-Methoxy-5-formylphenylboronic acid127972-02-549 % similar

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

Same formula

(2-Methoxy-1-naphthyl)boronic acid104116-17-8 6-Methoxy-2-naphthaleneboronic acid156641-98-4

Elsewhere

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