chempirical

6-Methoxy-2-naphthaleneboronic acid

C11H11BO3CAS 156641-98-4202.02 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
156641-98-4
SMILES
B(C1=CC2=C(C=C1)C=C(C=C2)OC)(O)O
InChIKey
GZFAVYWCPSMLCM-UHFFFAOYSA-N
InChI
InChI=1S/C11H11BO3/c1-15-11-5-3-8-6-10(12(13)14)4-2-9(8)7-11/h2-7,13-14H,1H3

Weigh it out

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

Work with 6-Methoxy-2-naphthaleneboronic 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

(4-Methoxyphenyl)boronic acid5720-07-068 % similar 2,6-Dimethoxynaphthalene5486-55-565 % similar (3-Methoxyphenyl)boronic acid10365-98-765 % similar 6-Ethoxynaphthalen-2-yl boronic acid352525-98-562 % similar 2,7-Dimethoxynaphthalene3469-26-957 % similar β-Naphthol methyl ether93-04-957 % similar 3,4-Dimethoxyphenylboronic acid122775-35-356 % similar 2-Naphthylboronic acid32316-92-053 % similar

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

Same formula

3-Methoxynaphthalene-2-boronic acid104115-76-6 (2-Methoxy-1-naphthyl)boronic acid104116-17-8

Elsewhere

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