3-(9H-Carbazol-9-yl)phenylboronic acid

C18H14BNO2CAS 864377-33-3287.13 g/mol

Open in Covalent MOL file
BNOHHO
Boronic acid

Properties

Molecular formula
C18H14BNO2
Molar mass
287.13 g/mol
Exact mass
287.1118 Da
logP
2.46Crippen estimate
Polar surface area
45.4 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number
864377-33-3
SMILES
B(C1=CC(=CC=C1)N2C3=CC=CC=C3C4=CC=CC=C42)(O)O
InChIKey
IDQUIFLAFFZYEX-UHFFFAOYSA-N
InChI
InChI=1S/C18H14BNO2/c21-19(22)13-6-5-7-14(12-13)20-17-10-3-1-8-15(17)16-9-2-4-11-18(16)20/h1-12,21-22H

Weigh it out

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

Work with 3-(9H-Carbazol-9-yl)phenylboronic 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-(2-Naphthalenyl)-9H-carbazole-3-yl] boronic acid1133057-98-364 % similar 9,9'-(1,3-Phenylene)bis-9H-carbazole550378-78-463 % similar (3-(Carbazole-9H)phenyl)pinacol ester870119-58-756 % similar 9-([1,1'-Biphenyl]-3-yl)-9H-carbazole1221237-87-154 % similar B-(6,9-Diphenyl-9H-carbazol-3-yl)boronic acid1133058-06-654 % similar 9-(3-Bromophenyl)carbazole185112-61-253 % similar 9-Phenylcarbazole1150-62-552 % similar 1,3,5-Tri(9-carbazolyl)benzene148044-07-952 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(9-Phenyl-9H-carbazol-2-yl)boronic acid1001911-63-2 B-[2-(9H-Carbazol-9-yl)phenyl]boronic acid1189047-28-6 4-(9H-Carbozol-9-yl)phenylboronic acid419536-33-7 9-Phenyl-9H-carbazole-3-boronic acid854952-58-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook