1,3,5-Triphenylbenzene - CAS 612-71-5

Catalog:	BB031032
Product Name:	1,3,5-Triphenylbenzene
CAS:	612-71-5
Synonyms:	1,3,5-triphenylbenzene

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Computed Properties

IUPAC Name:	1,3,5-triphenylbenzene
Description:	1,3,5-Triphenylbenzene (CAS# 612-71-5) is a useful research chemical.
Molecular Weight:	306.40
Molecular Formula:	C24H18
Canonical SMILES:	C1=CC=C(C=C1)C2=CC(=CC(=C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI:	InChI=1S/C24H18/c1-4-10-19(11-5-1)22-16-23(20-12-6-2-7-13-20)18-24(17-22)21-14-8-3-9-15-21/h1-18H
InChI Key:	SXWIAEOZZQADEY-UHFFFAOYSA-N
Boiling Point:	460 °C
Density:	1.074 g/cm³
Appearance:	Light brown crystalline powder
MDL:	MFCD00003060
LogP:	6.68760

Publication Number	Title	Priority Date
WO-2015192051-A1	Prelithiation solutions for lithium-ion batteries	20140612
WO-2015183384-A1	Process and device for removing water and/or oxygen from organic liquid	20140530
EP-2944670-A1	Inorganic filler-containing epoxy resin cured product and laminate including the same	20140515
WO-2015152633-A1	Heterocyclic compound and organic light-emitting device comprising same	20140404
US-2015267046-A1	Composition for film formation, resist underlayer film, and forming method of resist underlayer film, and pattern-forming method	20140320

PMID	Publication Date	Title	Journal
22374388	20120407	Polyphenylenepyridyl dendrimers as stabilizing and controlling agents for CdS nanoparticle formation	Nanoscale
22101304	20120107	1,3,5-Triphenylbenzene fluorophore as a selective Cu2+ sensor in aqueous media	Chemical communications (Cambridge, England)
21755073	20110828	A novel low density metal-organic framework with pcu topology by dendritic ligand	Chemical communications (Cambridge, England)
21744775	20110825	Thermodynamic insights on the structure and energetics of s-triphenyltriazine	The journal of physical chemistry. A
21612206	20110620	Enhanced π-conjugation and emission via icosahedral carboranes: synthetic and spectroscopic investigation	Inorganic chemistry

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GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	285
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	306.140850574
Formal Charge:	0
Heavy Atom Count:	24
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	306.140850574
Rotatable Bond Count:	3
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	6.8