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149454

Hexaphenylbenzene

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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Quality Segment

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

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 (personal protective equipment)

Eyeshields, Gloves, type N95 (US)

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