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2-Phenylnaphthalene

CAS No.:
612-94-2
Catalog Number:
AG003HVO
Molecular Formula:
C16H12
Molecular Weight:
204.2665
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>95.0%(GC)
1 week
United States
$596
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Product Description
Catalog Number:
AG003HVO
Chemical Name:
2-Phenylnaphthalene
CAS Number:
612-94-2
Molecular Formula:
C16H12
Molecular Weight:
204.2665
MDL Number:
MFCD00039601
IUPAC Name:
2-phenylnaphthalene
InChI:
InChI=1S/C16H12/c1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16/h1-12H
InChI Key:
TURIHPLQSRVWHU-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)c1ccc2c(c1)cccc2
EC Number:
210-324-6
UNII:
949VN5DH7A
NSC Number:
407592
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.094g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
204.272g/mol
Monoisotopic Mass:
204.094g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Literature
Title Journal
Synthesis of 2-phenylnaphthalenes through gold-catalyzed dimerization via a highly selective carbon nucleophile pathway. The Journal of organic chemistry 20110603
In silico prediction of estrogen receptor subtype binding affinity and selectivity using statistical methods and molecular docking with 2-arylnaphthalenes and 2-arylquinolines. International journal of molecular sciences 20100101
Protein engineering on biphenyl dioxygenase for conferring activity to convert 7-hydroxyflavone and 5,7-dihydroxyflavone (chrysin). Journal of bioscience and bioengineering 20080801
Quantitative structure-activity relationships for a series of selective estrogen receptor-beta modulators. SAR and QSAR in environmental research 20070101
Design, microwave-assisted synthesis, and spasmolytic activity of 2-(alkyloxyaryl)-1H-benzimidazole derivatives as constrained stilbene bioisosteres. Bioorganic & medicinal chemistry letters 20060815
The unexpected science of estrogen receptor-beta selective agonists: a new class of anti-inflammatory agents? Nuclear receptor signaling 20060101
Hole mobility and lifetime in a smectic liquid crystalline photoconductor of a 2-phenylnaphthalene derivative. The Journal of chemical physics 20051222
Degradation of benz[a]anthracene by Mycobacterium vanbaalenii strain PYR-1. Biodegradation 20051201
Electronic and ionic transports for negative charge carriers in smectic liquid crystalline photoconductor. The journal of physical chemistry. B 20051201
Photocyclization of 2-vinyldiphenylacetylenes and behavior of the isonaphthalene intermediates. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20050801
ERbeta ligands. 3. Exploiting two binding orientations of the 2-phenylnaphthalene scaffold to achieve ERbeta selectivity. Journal of medicinal chemistry 20050616
What contributes to the combined effect of a complex mixture? Environmental science & technology 20041201
Concise three-component synthesis of defucogilvocarcin M. Organic letters 20040722
Thiophenes as traps for benzyne. 3. Diaryl sulfides and the role of dipolar intermediates. The Journal of organic chemistry 20030110
Properties