2,4-Di(3-biphenylyl)-6-chloro-1,3,5-triazine - CAS 1205748-61-3

Catalog:	BB004914
Product Name:	2,4-Di(3-biphenylyl)-6-chloro-1,3,5-triazine
CAS:	1205748-61-3
Synonyms:	2-chloro-4,6-bis(3-phenylphenyl)-1,3,5-triazine; 2-chloro-4,6-bis(3-phenylphenyl)-1,3,5-triazine

Technical Data

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Computed Properties

IUPAC Name:	2-chloro-4,6-bis(3-phenylphenyl)-1,3,5-triazine
Description:	2,4-Di(3-biphenylyl)-6-chloro-1,3,5-triazine (CAS# 1205748-61-3 ) is a useful research chemical.
Molecular Weight:	419.90
Molecular Formula:	C27H18ClN3
Canonical SMILES:	C1=CC=C(C=C1)C2=CC(=CC=C2)C3=NC(=NC(=N3)Cl)C4=CC=CC(=C4)C5=CC=CC=C5
InChI:	InChI=1S/C27H18ClN3/c28-27-30-25(23-15-7-13-21(17-23)19-9-3-1-4-10-19)29-26(31-27)24-16-8-14-22(18-24)20-11-5-2-6-12-20/h1-18H
InChI Key:	SVNMSEVGOAHNKQ-UHFFFAOYSA-N
LogP:	7.19300

Publication Number	Title	Priority Date
WO-2021118217-A2	Heterocyclic compound and organic light-emitting device comprising same	20191209
US-2021057651-A1	Organic light emitting device, method for manufacturing same and composition for organic material layer	20190823
WO-2021015497-A1	Heterocyclic compound and organic light emitting device comprising same	20190722
US-2020274070-A1	Compound and organic electronic device using the same	20190227
KR-20200076814-A	Organic compounds and organic electro luminescence device comprising the same	20181219

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Complexity:	499
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	419.1189253
Formal Charge:	0
Heavy Atom Count:	31
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	419.1189253
Rotatable Bond Count:	4
Topological Polar Surface Area:	38.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	7.5