4,4'-Dimethylbiphenyl - CAS 613-33-2

Catalog:	BB031060
Product Name:	4,4'-Dimethylbiphenyl
CAS:	613-33-2
Synonyms:	1-methyl-4-(4-methylphenyl)benzene

Technical Data

Patents

Literatures

Computed Properties

IUPAC Name:	1-methyl-4-(4-methylphenyl)benzene
Description:	4,4'-Bitoluene was used in preparation of in various cross-coupling reactions.
Molecular Weight:	182.26
Molecular Formula:	C14H14
Canonical SMILES:	CC1=CC=C(C=C1)C2=CC=C(C=C2)C
InChI:	InChI=1S/C14H14/c1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14/h3-10H,1-2H3
InChI Key:	RZTDESRVPFKCBH-UHFFFAOYSA-N
Boiling Point:	295 °C
Density:	1.102 g/cm³
MDL:	MFCD00008545
LogP:	3.97040

Publication Number	Title	Priority Date
CN-113224279-A	Silica-based composite negative electrode material capable of improving first coulombic efficiency and preparation method thereof	20210707
CN-113224279-B	Silica-based composite negative electrode material capable of improving first coulombic efficiency and preparation method thereof	20210707
CN-113363413-A	Pre-lithiated silicon-based negative electrode plate and preparation method and application thereof	20210602
CN-113075346-A	Gas chromatography separation analysis method based on aromatic macrocycle, molecular cage and pillar quinone and application	20210401
CN-113097451-A	Pre-lithiation method, pre-lithiation negative plate and lithium ion battery	20210401

PMID	Publication Date	Title	Journal
23035950	20121019	Improved nonlinearity-transparency-thermal stability trade-off with spirobifluorene-bridged donor-π-acceptor chromophores	Organic letters
22316113	20120222	Fluorescence enhancement of di-p-tolyl viologen by complexation in cucurbit[7]uril	Journal of the American Chemical Society
20055397	20100204	Excited states of [3.3](4,4')biphenylophane: the role of charge-transfer excitations in dimers with pi-pi interaction	The journal of physical chemistry. A
17156750	20070126	A comparison of substrate dynamics in human CYP2E1 and CYP2A6	Biochemical and biophysical research communications
16838937	20051110	Selective oxygenation of 4,4'-dimethylbiphenyl with molecular oxygen, catalyzed by 9-phenyl-10-methylacridinium ion via photoinduced electron transfer	The journal of physical chemistry. A

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Complexity:	137
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:	0
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	5.1