AG003FO1

10368-47-5 | 2,4,6-Triphenylnitrobenzene

AG003FO1

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CAS Number	10368-47-5
Catalog Number	AG003FO1(AGN-PC-0KPCEQ)
Chemical Name	2,4,6-Triphenylnitrobenzene
IUPAC Name	2-nitro-1,3,5-triphenylbenzene
InChI	InChI=1S/C24H17NO2/c26-25(27)24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20/h1-17H
InChI Key	VCRVMYZAKLXTFQ-UHFFFAOYSA-N
MDL Number	MFCD00060090
Molecular Formula	C24H17NO2
Molecular Weight	351.3973
SMILES	C1(=CC=CC=C1)C1=C(C(=CC(=C1)C1=CC=CC=C1)C1=CC=CC=C1)[N+](=O)[O-]
Synonyms	2,4,6-Triphenylnitrobenzene, 10368-47-5, 2-nitro-1,3,5-triphenylbenzene, 2'-Nitro-5'-phenyl-1,1':3',1''-terphenyl, BAS 00451621, AC1MJ7M0, ACMC-20988v, SCHEMBL9747267, CTK4A2318, DTXSID60389308, RCL R247081, ZINC2169674, ANW-14957, MFCD00060090, AKOS000618762, MCULE-6489062792, TC-103702, ST50730952, 1,1':3',1''-Terphenyl,2'-nitro-5'-phenyl-, C-44718, I14-55610, CID3107828, T0518,

Complexity	441
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	351.126g/mol
Formal Charge	0
Heavy Atom Count	27
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	351.405g/mol
Monoisotopic Mass	351.126g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	45.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	6.6

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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