9-(4-bromophenyl)-N3,N3,N6,N6-tetraphenyl-carbazole-3,6-diamine

This is a physical chemical entity[CHEBI_24431] associated with a molecule[CHEBI_25367].
The molecule[CHEBI_25367] can be described by the following structural desciptors[cheminf_000085]:
InChI descriptor[cheminf_000113]: InChI=1S/C42H30BrN3/c43-31-21-23-36(24-22-31)46-41-27-25-37(44(32-13-5-1-6-14-32)33-15-7-2-8-16-33)29-39(41)40-30-38(26-28-42(40)46)45(34-17-9-3-10-18-34)35-19-11-4-12-20-35/h1-30H, and canonical SMILES descriptor[cheminf_000007]: Brc1ccc(cc1)n1c2ccc(cc2c2c1ccc(c2)N(c1ccccc1)c1ccccc1)N(c1ccccc1)c1ccccc1, and by the IUPAC name[cheminf_000107]: 9-(4-bromophenyl)-3-N,3-N,6-N,6-N-tetraphenylcarbazole-3,6-diamine.

The physical chemical entity[CHEBI_24431] has a component solvent[CHEBI_46787] which is described by the canonical SMILES descriptor[cheminf_000007]:

The physical chemical entity[CHEBI_24431] has the following Sample ID as registered in the research data repository chemotion (www.chemotion-repository.net, https://doi.org/10.25504/FAIRsharing.iagXcR): CRS-30028

The physical chemical entity[CHEBI_24431] can be described by the physical descriptors [CHEMINF_000025]:
Melting point descriptor[CHEMINF_000256]: 136.5 - 142.6 (°C)
Boiling point descriptor[CHEMINF_000257]:
Refractive index descriptor[CHEMINF_000253]:

The physical chemical entity[CHEBI_24431] can be further described by the following assays[OBI:0000070][CHMO:0001133]:

CHMO:0000593 | 1H nuclear magnetic resonance spectroscopy (1H NMR)

CHMO:0000595 | 13C nuclear magnetic resonance spectroscopy (13C NMR)

CHMO:0000630 | infrared absorption spectroscopy (IR)

CHMO:0000470 | mass spectrometry (MS)

CHMO:0001146 | 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

CHMO:0001150 | 1H--1H correlation spectroscopy (1H-1H COSY)

The physical chemical entity[CHEBI_24431] was deposited to the Molecule Archive of the Karlsruhe Insitute of Technology (KIT) with the following Sample ID:

Used ontologies:
CHEBI - Chemical Entities of Biological Interest
CHEMINF - chemical information ontology (information entities about chemical entities)
CHMO - Chemical Methods Ontology
OBI - Ontology for Biomedical Investigations