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149454

Hexaphenylbenzene

Name: Hexaphenylbenzene
Brand: ALDRICH

98%

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About This Item

Linear Formula:

C₆(C₆H₅)₆

CAS Number:

992-04-1

Molecular Weight:

534.69

NACRES:

NA.22

PubChem Substance ID:

24848955

UNSPSC Code:

12352100

EC Number:

213-591-7

MDL number:

MFCD00003057

Assay:

98%

Form:

solid

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Properties

Quality Level

100

assay

98%

form

solid

mp

>300 °C (lit.)

functional group

phenyl

SMILES string

c1ccc(cc1)-c2c(-c3ccccc3)c(-c4ccccc4)c(-c5ccccc5)c(-c6ccccc6)c2-c7ccccc7

InChI

1S/C42H30/c1-7-19-31(20-8-1)37-38(32-21-9-2-10-22-32)40(34-25-13-4-14-26-34)42(36-29-17-6-18-30-36)41(35-27-15-5-16-28-35)39(37)33-23-11-3-12-24-33/h1-30H

InChI key

QBHWPVJPWQGYDS-UHFFFAOYSA-N

Description

Application

Hexaphenylbenzene can be used as a starting material to synthesize:

1,2,3,4,5,6-Hexacyclohexylcyclohexane by Pd/C catalyzed hydrogenation reaction.
Stable hexatrityl cations and porous organic polymers for applications in catalysis and gas storage.
Hexa-peri-hexabenzocoronene via one-pot substitution and oxidative cyclodehydrogenation reaction in the presence of t-BuCl/FeCl₃.

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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From Hexaphenylbenzene to 1,2,3,4,5,6-Hexacyclohexylcyclohexane

Dillenburger M, et al.

Journal of the American Chemical Society, 142(30), 12916-12920 (2020)

Porous organic polymers based on propeller-like hexaphenylbenzene building units

Chen Q, et al.

Macromolecules, 44(14), 5573-5577 (2011)

Cyanide modulated fluorescent supramolecular assembly of a hexaphenylbenzene derivative for detection of trinitrotoluene at the attogram level.

Vandana Bhalla et al.

Chemical communications (Cambridge, England), 49(9), 895-897 (2012-12-19)

Fluorescent nanorods formed by self-assembly of hexaphenylbenzene derivative in the presence of cyanide ions serve as a sensitive colorimetric and fluorogenic sensor for the detection of trinitrotoluene (TNT) at the attogram (10(-18) g) level with a detection limit of 10.21

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Global Trade Item Number

SKU	GTIN
149454-1G	04061838738387