2-Anthraceneboronic Acid (contains varying amounts of Anhydride)

C₁₄H₁₁BO₂CAS 141981-64-8222.05 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₁BO₂
Molar mass: 222.05 g/mol
Exact mass: 222.0852 Da
logP: 1.67Crippen estimate
Polar surface area: 40.5 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 1

Identifiers

CAS number

141981-64-8

SMILES

B(C1=CC2=CC3=CC=CC=C3C=C2C=C1)(O)O

InChIKey

PKWBMOXZIMVOJT-UHFFFAOYSA-N

InChI

InChI=1S/C14H11BO2/c16-15(17)14-6-5-12-7-10-3-1-2-4-11(10)8-13(12)9-14/h1-9,16-17H

Weigh it out

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

Names and synonyms

1 names

2-Anthraceneboronic acid

Work with 2-Anthraceneboronic Acid (contains varying amounts of Anhydride)

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-Naphthylboronic acid32316-92-086 % similar B-(6-Hydroxy-2-naphthalenyl)boronic acid173194-95-159 % similar Pentacene135-48-852 % similar Tetracene92-24-052 % similar Benzo[b]naphtho[2,3-d]furan-2-boronic acid1627917-17-252 % similar Phenylboronic acid98-80-650 % similar Anthracene120-12-748 % similar [9-(2-Naphthalenyl)-9H-carbazole-3-yl] boronic acid1133057-98-347 % similar

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

Same formula

9-Anthraceneboronic acid100622-34-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook