3-Phenyl-9-phenylcarbazole-6-boronic acid pinacol ester

C₃₀H₂₈BNO₂CAS 1359833-28-5445.37 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃₀H₂₈BNO₂
Molar mass: 445.37 g/mol
Exact mass: 445.2213 Da
logP: 6.75Crippen estimate
Polar surface area: 23.4 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 3

Identifiers

CAS number

1359833-28-5

SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC3=C(C=C2)N(C4=C3C=C(C=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChIKey

QVMVGEABPNCFOY-UHFFFAOYSA-N

InChI

InChI=1S/C30H28BNO2/c1-29(2)30(3,4)34-31(33-29)23-16-18-28-26(20-23)25-19-22(21-11-7-5-8-12-21)15-17-27(25)32(28)24-13-9-6-10-14-24/h5-20H,1-4H3

Weigh it out

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

Names and synonyms

1 names

3,9-Diphenyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole

Work with 3-Phenyl-9-phenylcarbazole-6-boronic acid pinacol ester

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-Phenyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)carbazole1126522-69-779 % similar 9- Phenyl-2-(4,4,5,5-tetramethyl- 1,3,2-dioxaborolan-2-yl)-9H-carbazole1246669-45-367 % similar B-(6,9-Diphenyl-9H-carbazol-3-yl)boronic acid1133058-06-661 % similar 4,4,5,5-Tetramethyl-2-(3-(triphenylen-2-yl)phenyl)-1,3,2-dioxaborolane1115639-92-355 % similar 3-Bromo-6,9-diphenyl-9H-carbazole1160294-85-851 % similar 2,4-Diphenyl-6-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1,3,5-triazine1219956-23-649 % similar 9-(1,1-Bipheny)-4-yl-3-(4-bromophenyl)carbazole1028648-25-046 % similar 2,4-Diphenyl-6-(3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)-1,3,5-triazine1269508-31-746 % similar

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

Same formula

9-([1,1'-Biphenyl]-4-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole1391729-66-0 9-((1,1'-Biphenyl)-3-yl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-9H-carbazole1533406-38-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook