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5'-Phenyl-[1,1':3',1''-terphenyl]-2'-carbaldehyde

5'-Phenyl-[1,1':3',1''-terphenyl]-2'-carbaldehyde - CAS 85390-98-3

Catalog:	BB037608
Product Name:	5'-Phenyl-[1,1':3',1''-terphenyl]-2'-carbaldehyde
CAS:	85390-98-3
Synonyms:	2,4,6-triphenylbenzaldehyde; 2,4,6-triphenylbenzaldehyde

Technical Data

Patents

Computed Properties

IUPAC Name:	2,4,6-triphenylbenzaldehyde
Description:	5'-Phenyl-[1,1':3',1''-terphenyl]-2'-carbaldehyde (CAS# 85390-98-3 ) is a useful research chemical.
Molecular Weight:	334.41
Molecular Formula:	C25H18O
Canonical SMILES:	C1=CC=C(C=C1)C2=CC(=C(C(=C2)C3=CC=CC=C3)C=O)C4=CC=CC=C4
InChI:	InChI=1S/C25H18O/c26-18-25-23(20-12-6-2-7-13-20)16-22(19-10-4-1-5-11-19)17-24(25)21-14-8-3-9-15-21/h1-18H
InChI Key:	IQCJKKFSTPHNEX-UHFFFAOYSA-N
LogP:	6.50010

Publication Number	Title	Priority Date
JP-2014195800-A	Porphyrinic catalyst, porphyrin compound, and method for manufacturing a porphyrin compound	20130304
US-2013112920-A1	Metal complexes	20100716
US-9331290-B2	Metal complexes	20100716
WO-2012007086-A1	Metal complexes	20100716
EP-1790640-A1	Novel imidazolidine derivative and use thereof	20040909

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Complexity:	397
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	334.135765193
Formal Charge:	0
Heavy Atom Count:	26
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	334.135765193
Rotatable Bond Count:	4
Topological Polar Surface Area:	17.1
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	6.3