2,5-Dimethyl-1,1'-biphenyl - CAS 7372-85-2

Name: 2,5-Dimethyl-1,1'-biphenyl
Brand: BOC Sciences
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Catalog:	BB067177
Product Name:	2,5-Dimethyl-1,1'-biphenyl
CAS:	7372-85-2
Synonyms:	2,5-Dimethyl-1,1'-biphenyl; 1,4-Dimethyl-2-phenylbenzene; 2,5-Dimethylbiphenyl; 2,5-Dimethyldiphenyl; 2-Phenyl-1,4-xylene

Technical Data

IUPAC Name:	1,4-dimethyl-2-phenylbenzene
Description:	2,5-Dimethyl-1,1'-biphenyl is a useful reagent for organic synthesis. It is used in the preparation of orthopalladated phosphorus ylide complexes and palladium nanoparticles as catalyst for Suzuki coupling reactions.
Molecular Weight:	182.26
Molecular Formula:	C14H14
Canonical SMILES:	CC1=CC(=C(C=C1)C)C2=CC=CC=C2
InChI:	InChI=1S/C14H14/c1-11-8-9-12(2)14(10-11)13-6-4-3-5-7-13/h3-10H,1-2H3
InChI Key:	ASHRVEUMINIGNW-UHFFFAOYSA-N
References:	Karami, K., et al. Appl. Organomet. Chem., 31, 11 (2017); Augustyniak, A. W., et al. Dalton Trans., 45, 1325 (2016).

Complexity:	167
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	182.109550447
Formal Charge:	0
Heavy Atom Count:	14
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	182.109550447
Rotatable Bond Count:	1
Topological Polar Surface Area:	0Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	4.3