Home Other Building Blocks 1-ethynyl-2-phenylbenzene

1-ethynyl-2-phenylbenzene

CAS No.:
52889-62-0
Catalog Number:
AG01ALSW
Molecular Formula:
C14H10
Molecular Weight:
178.2292
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Product Description
Catalog Number:
AG01ALSW
Chemical Name:
1-ethynyl-2-phenylbenzene
CAS Number:
52889-62-0
Molecular Formula:
C14H10
Molecular Weight:
178.2292
MDL Number:
MFCD28016698
IUPAC Name:
1-ethynyl-2-phenylbenzene
InChI:
InChI=1S/C14H10/c1-2-12-8-6-7-11-14(12)13-9-4-3-5-10-13/h1,3-11H
InChI Key:
NAWUZMMAZOQEEA-UHFFFAOYSA-N
SMILES:
C#Cc1ccccc1c1ccccc1
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.078g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.234g/mol
Monoisotopic Mass:
178.078g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  
Literature
Title Journal
Organo- and hydrogelators based on luminescent monocationic terpyridyl platinum(II) complexes with biphenylacetylide ligands. Chemistry, an Asian journal 20111104
Microwave flash pyrolysis. The Journal of organic chemistry 20090605
Thermal rearrangements of 2-ethynylbiphenyl: a DFT study of competing reaction mechanisms. The Journal of organic chemistry 20090116
22pi smaragdyrin molecular conjugates with aromatic phenylacetylenes and ferrocenes: Syntheses, electrochemical, and photonic properties. Journal of the American Chemical Society 20061220
Solvent dependent photocyclization and photophysics of some 2-ethynylbiphenyls. Photochemical & photobiological sciences : Official journal of the European Photochemistry Association and the European Society for Photobiology 20060401
Modified (22pi) smaragdyrins with large two-photon absorption cross section: a structure function correlation. Organic letters 20060216
[Drug interactions between nonsteroidal anti-inflammatory drug and pazufloxacin mesilate, a new quinolone antibacterial agent for intravenous use: convulsions in mice after intravenous or intracerebroventricular administration]. The Japanese journal of antibiotics 20020601
Properties