992-04-1,MFCD00003057
Catalog No.:AA003QU9

992-04-1 | HEXAPHENYLBENZENE

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$21.00   $15.00
- +
1g
95%
in stock  
$56.00   $39.00
- +
5g
95%
in stock  
$227.00   $159.00
- +
25g
95%
in stock  
$792.00   $555.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003QU9
Chemical Name:
HEXAPHENYLBENZENE
CAS Number:
992-04-1
Molecular Formula:
C42H30
Molecular Weight:
534.6876
MDL Number:
MFCD00003057
SMILES:
c1ccc(cc1)c1c(c2ccccc2)c(c2ccccc2)c(c(c1c1ccccc1)c1ccccc1)c1ccccc1
NSC Number:
220313
Properties
Properties
 
BP:
534.8°C at 760 mmHg  
Form:
Solid  
Storage:
Room Temperature;Keep in dry area;  

Computed Properties
 
Complexity:
579  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
42  
Hydrogen Bond Acceptor Count:
0  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
11.7  

Literature

Title: Recognition of adenosine monophosphate and H2PO4- using zinc ensemble of new hexaphenylbenzene derivative: potential bioprobe and multichannel keypad system.

Journal: Organic letters 20120217

Title: Structural and thermodynamic characterization of polyphenylbenzenes.

Journal: The journal of physical chemistry. A 20111027

Title: C60-induced alkyne-alkyne coupling and alkyne scission reactions of a tungsten tris(diphenylacetylene) complex.

Journal: Chemical communications (Cambridge, England) 20110207

Title: Hexaphenylbenzene as a rigid template for the straightforward syntheses of 'star-shaped' glycodendrimers.

Journal: The Journal of organic chemistry 20110121

Title: New hyperbranched conjugated polymers containing hexaphenylbenzene and oxadiazole units: convenient synthesis and efficient deep blue emitters for PLEDs application.

Journal: The journal of physical chemistry. B 20100722

Title: Photochemical 'triode' molecular signal transducer.

Journal: Journal of the American Chemical Society 20100512

Title: Preparation of a tetraphenylethylene-based emitter: synthesis, structure and optoelectronic properties of tetrakis(pentaphenylphenyl)ethylene.

Journal: Chemical communications (Cambridge, England) 20100221

Title: Multiantenna artificial photosynthetic reaction center complex.

Journal: The journal of physical chemistry. B 20090521

Title: Efficient synthesis of symmetrically and unsymmetrically substituted hexaphenylbenzene analogues by suzuki-miyaura coupling reactions.

Journal: Chemistry, an Asian journal 20080407

Title: Birch reduction of hexaphenyl- and pentaphenylbenzene and an X-ray crystallography and NMR spectroscopy study of cis- and epi-1,2,3,4,5,6-hexaphenylcyclohexane and of 2,3,5,6-tetraphenyl-1,1'-bicyclohexylidene: Cannizzaro's conundrum revisited.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20080101

Title: Engineering hydrogen-bonded molecular crystals built from derivatives of hexaphenylbenzene and related compounds.

Journal: Journal of the American Chemical Society 20070411

Title: Simultaneous ejection of six electrons at a constant potential by hexakis(4-ferrocenylphenyl)benzene.

Journal: Organic letters 20061026

Title: Investigation of the mechanism of the intramolecular Scholl reaction of contiguous phenylbenzenes.

Journal: The Journal of organic chemistry 20060707

Title: Energy and photoinduced electron transfer in a wheel-shaped artificial photosynthetic antenna-reaction center complex.

Journal: Journal of the American Chemical Society 20060215

Title: Inner shell excitation spectroscopy of biphenyl and substituted biphenyls: probing ring-ring delocalization.

Journal: The journal of physical chemistry. A 20051208

Title: 7-Azaindolyl- and 2,2'-dipyridylamino-functionalized molecular stars with sixfold symmetry: self-assembly, luminescence, and coordination compounds.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20050121

Title: A slippery slope: mechanistic analysis of the intramolecular Scholl reaction of hexaphenylbenzene.

Journal: Journal of the American Chemical Society 20041124

Title: Hopping of a single hole in hexakis[4-(1,1,2-triphenyl-ethenyl)phenyl]benzene cation radical through the hexaphenylbenzene propeller.

Journal: Organic letters 20040527

Title: Synthesis and isolation of polytrityl cations by utilizing hexaphenylbenzene and tetraphenylmethane scaffolds.

Journal: The Journal of organic chemistry 20040305

Title: A practical one-pot synthesis of soluble hexa-peri-hexabenzocoronene and isolation of its cation-radical salt.

Journal: The Journal of organic chemistry 20030516

Title: Synthesis and structure of a polyphenylene macrocycle related to 'cubic graphite'.

Journal: Organic letters 20030206

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SDS
Tags:992-04-1 Molecular Formula|992-04-1 MDL|992-04-1 SMILES|992-04-1 HEXAPHENYLBENZENE
Catalog No.: AA003QU9
992-04-1,MFCD00003057
992-04-1 | HEXAPHENYLBENZENE
Pack Size: 250mg
Purity: 95%
in stock
$21.00 $15.00
Pack Size: 1g
Purity: 95%
in stock
$56.00 $39.00
Pack Size: 5g
Purity: 95%
in stock
$227.00 $159.00
Pack Size: 25g
Purity: 95%
in stock
$792.00 $555.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA003QU9
Chemical Name: HEXAPHENYLBENZENE
CAS Number: 992-04-1
Molecular Formula: C42H30
Molecular Weight: 534.6876
MDL Number: MFCD00003057
SMILES: c1ccc(cc1)c1c(c2ccccc2)c(c2ccccc2)c(c(c1c1ccccc1)c1ccccc1)c1ccccc1
NSC Number: 220313
Properties
BP: 534.8°C at 760 mmHg  
Form: Solid  
Storage: Room Temperature;Keep in dry area;  
Complexity: 579  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 42  
Hydrogen Bond Acceptor Count: 0  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 11.7  
Literature fold

Title: Recognition of adenosine monophosphate and H2PO4- using zinc ensemble of new hexaphenylbenzene derivative: potential bioprobe and multichannel keypad system.

Journal: Organic letters20120217

Title: Structural and thermodynamic characterization of polyphenylbenzenes.

Journal: The journal of physical chemistry. A20111027

Title: C60-induced alkyne-alkyne coupling and alkyne scission reactions of a tungsten tris(diphenylacetylene) complex.

Journal: Chemical communications (Cambridge, England)20110207

Title: Hexaphenylbenzene as a rigid template for the straightforward syntheses of 'star-shaped' glycodendrimers.

Journal: The Journal of organic chemistry20110121

Title: New hyperbranched conjugated polymers containing hexaphenylbenzene and oxadiazole units: convenient synthesis and efficient deep blue emitters for PLEDs application.

Journal: The journal of physical chemistry. B20100722

Title: Photochemical 'triode' molecular signal transducer.

Journal: Journal of the American Chemical Society20100512

Title: Preparation of a tetraphenylethylene-based emitter: synthesis, structure and optoelectronic properties of tetrakis(pentaphenylphenyl)ethylene.

Journal: Chemical communications (Cambridge, England)20100221

Title: Multiantenna artificial photosynthetic reaction center complex.

Journal: The journal of physical chemistry. B20090521

Title: Efficient synthesis of symmetrically and unsymmetrically substituted hexaphenylbenzene analogues by suzuki-miyaura coupling reactions.

Journal: Chemistry, an Asian journal20080407

Title: Birch reduction of hexaphenyl- and pentaphenylbenzene and an X-ray crystallography and NMR spectroscopy study of cis- and epi-1,2,3,4,5,6-hexaphenylcyclohexane and of 2,3,5,6-tetraphenyl-1,1'-bicyclohexylidene: Cannizzaro's conundrum revisited.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany)20080101

Title: Engineering hydrogen-bonded molecular crystals built from derivatives of hexaphenylbenzene and related compounds.

Journal: Journal of the American Chemical Society20070411

Title: Simultaneous ejection of six electrons at a constant potential by hexakis(4-ferrocenylphenyl)benzene.

Journal: Organic letters20061026

Title: Investigation of the mechanism of the intramolecular Scholl reaction of contiguous phenylbenzenes.

Journal: The Journal of organic chemistry20060707

Title: Energy and photoinduced electron transfer in a wheel-shaped artificial photosynthetic antenna-reaction center complex.

Journal: Journal of the American Chemical Society20060215

Title: Inner shell excitation spectroscopy of biphenyl and substituted biphenyls: probing ring-ring delocalization.

Journal: The journal of physical chemistry. A20051208

Title: 7-Azaindolyl- and 2,2'-dipyridylamino-functionalized molecular stars with sixfold symmetry: self-assembly, luminescence, and coordination compounds.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany)20050121

Title: A slippery slope: mechanistic analysis of the intramolecular Scholl reaction of hexaphenylbenzene.

Journal: Journal of the American Chemical Society20041124

Title: Hopping of a single hole in hexakis[4-(1,1,2-triphenyl-ethenyl)phenyl]benzene cation radical through the hexaphenylbenzene propeller.

Journal: Organic letters20040527

Title: Synthesis and isolation of polytrityl cations by utilizing hexaphenylbenzene and tetraphenylmethane scaffolds.

Journal: The Journal of organic chemistry20040305

Title: A practical one-pot synthesis of soluble hexa-peri-hexabenzocoronene and isolation of its cation-radical salt.

Journal: The Journal of organic chemistry20030516

Title: Synthesis and structure of a polyphenylene macrocycle related to 'cubic graphite'.

Journal: Organic letters20030206

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