chempirical

(2-Methoxy-9,9-dimethyl-9H-fluoren-3-yl)boronic acid

C16H17BO3CAS 2177237-24-8268.12 g/mol

Open in Covalent MOL file
BOOHHO
Boronic acidEther

Properties

Molecular formula
C16H17BO3
Molar mass
268.12 g/mol
Exact mass
268.1271 Da
logP
1.68Crippen estimate
Polar surface area
49.7 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

Identifiers

CAS number
2177237-24-8
SMILES
B(C1=CC2=C(C=C1OC)C(C3=CC=CC=C32)(C)C)(O)O
InChIKey
ARBOJNRAVITBBB-UHFFFAOYSA-N
InChI
InChI=1S/C16H17BO3/c1-16(2)12-7-5-4-6-10(12)11-8-14(17(18)19)15(20-3)9-13(11)16/h4-9,18-19H,1-3H3

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Work with (2-Methoxy-9,9-dimethyl-9H-fluoren-3-yl)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

3-Methoxynaphthalene-2-boronic acid104115-76-652 % similar 2-Methoxyphenylboronic acid5720-06-946 % similar 2,5-Dimethoxyphenylboronic acid107099-99-043 % similar 2,4-Dimethoxybenzeneboronic acid133730-34-443 % similar 2-Methoxy-5-(trifluoromethyl)phenylboronic acid240139-82-642 % similar 5-Fluoro-2-methoxyphenylboronic acid179897-94-041 % similar 5-Bromo-2-methoxyphenylboronic acid89694-45-141 % similar 5-Chloro-2-methoxyphenylboronic acid89694-48-441 % similar

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

Elsewhere

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