10-(1-Naphthyl)anthracene-9-boronic acid

C₂₄H₁₇BO₂CAS 400607-46-7348.21 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₄H₁₇BO₂
Molar mass: 348.21 g/mol
Exact mass: 348.1322 Da
logP: 4.49Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
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

400607-46-7

SMILES

B(C1=C2C=CC=CC2=C(C3=CC=CC=C13)C4=CC=CC5=CC=CC=C54)(O)O

InChIKey

ASQXKNXJNDLXQV-UHFFFAOYSA-N

InChI

InChI=1S/C24H17BO2/c26-25(27)24-21-13-5-3-11-19(21)23(20-12-4-6-14-22(20)24)18-15-7-9-16-8-1-2-10-17(16)18/h1-15,26-27H

Weigh it out

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Names and synonyms

1 names

[10-(1-Naphthalenyl)-9-anthracenyl]boronic acid

Work with 10-(1-Naphthyl)anthracene-9-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

9,10-Di(1-naphthyl)anthracene26979-27-169 % similar (10-Phenylanthracen-9-yl)boronic acid334658-75-258 % similar 9-Anthraceneboronic acid100622-34-257 % similar 9-(Naphthalen-1-yl)anthracene7424-70-657 % similar 9-Bromo-10-(naphthalen-1-yl)anthracene400607-04-756 % similar 4-(Naphthalen-1-yl)phenylboronic acid870774-25-756 % similar B-(10-[1,1′-Biphenyl]-4-yl-9-anthracenyl)boronic acid400607-47-855 % similar 3-(1-Naphthyl)phenylboronic Acid (contains varying amounts of Anhydride)881913-20-854 % similar

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

Same formula

10-(2-Naphthyl)anthracene-9-boronic acid597554-03-5

Elsewhere

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