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Sigma-Aldrich

2-Phenyltoluene

97%

Synonym(s):

2-Methylbiphenyl

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About This Item

Linear Formula:
C6H5C6H4CH3
CAS Number:
Molecular Weight:
168.23
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

refractive index

n20/D 1.591 (lit.)

bp

255.3 °C (lit.)

density

1.011 g/mL at 25 °C (lit.)

SMILES string

Cc1ccccc1-c2ccccc2

InChI

1S/C13H12/c1-11-7-5-6-10-13(11)12-8-3-2-4-9-12/h2-10H,1H3

InChI key

ALLIZEAXNXSFGD-UHFFFAOYSA-N

General description

Density functional theory calculations for the radical anions of 2-phenyltoluene (2-methylbiphenyl) has been reported. Cyclodehydrogenation of 2-phenyltoluene (2-methylbiphenyl) and its conversion to fluorene nucleus by vapor-phase treatment with palladium catalyst has been reported.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

224.6 °F - closed cup

Flash Point(C)

107 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Aromatic Cyclodehydrogenation. III. Experiments with 2-Ethylbiphenyl1
Orchin M.
Journal of the American Chemical Society, 68(4), 571-572 (1946)
Investigation of the effects of substitution position on the radical anions of chlorobiphenyls.
Pan D and Phillips DL.
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