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Key Documents

429082

Sigma-Aldrich

Hexamethylbenzene

purified by sublimation, ≥99%

동의어(들):

1,2,3,4,5,6-Hexamethylbenzene

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About This Item

Linear Formula:
C6(CH3)6
CAS Number:
Molecular Weight:
162.27
Beilstein:
1905834
EC Number:
MDL number:
UNSPSC 코드:
12352100
PubChem Substance ID:
NACRES:
NA.22

분석

≥99%

정제법

sublimation

bp

264 °C (lit.)

mp

164-166 °C (lit.)

SMILES string

Cc1c(C)c(C)c(C)c(C)c1C

InChI

1S/C12H18/c1-7-8(2)10(4)12(6)11(5)9(7)3/h1-6H3

InChI key

YUWFEBAXEOLKSG-UHFFFAOYSA-N

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일반 설명

Hexamethylbenzene (HMB) is a methyl benzene derivative. Its overtone spectra in carbon tetrachloride solution shows doublet structure due to two types of configurationally inequivalent hydrogens. The heat of solution of crystalline HMB has been obtained at 25°C from which the heat of fusion has been deduced by extrapolation process. The internal motion of the methyl groups has been explained by empirical force field calculations. Polarized Raman spectra of HMB at room temperature have been analyzed.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

개인 보호 장비

Eyeshields, Gloves, type N95 (US)


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문서 라이브러리 방문

The Raman spectrum of hexamethylbenzene single crystal.
Girlando A and Pecile C.
Chemical Physics Letters, 20(5), 467-470 (1973)
On the gearing of methyl groups in hexamethylbenzene.
Iroff LD.
Journal of Computational Chemistry, 1(1), 76-80 (1980)
Detailed features in the local mode overtone bands of ethane, neopentane, tetramethylbutane, and hexamethylbenzene.
Henry BR and Greenlay WRA.
J. Chem. Phys., 72(10), 5516-5524 (1980)
The Heats of Solution of Hexamethylbenzene, Cetyl Alcohol, and Dicetyl in Related Liquids; Heats of Fusion by an Extrapolation Process.
Parks GS and Rowe RD.
J. Chem. Phys. , 14(9), 507-510 (1946)
Yaw Kai Yan et al.
Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry, 11(4), 483-488 (2006-04-11)
Ruthenium(II) arene anticancer complexes [(eta6-arene)Ru(en)Cl]PF6 (arene is hexamethylbenzene, p-cymene, indan; en is ethylenediamine) can catalyse regioselective reduction of NAD+ by formate in water to form 1,4-NADH, at pD 7.2, 37 degrees C, and in the presence of air. The catalytic

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