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28910

Sigma-Aldrich

1,4-Cyclohexadiene

purum, ≥97.0% (GC)

Sinónimos:

1,4-Dihydrobenzene

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About This Item

Fórmula empírica (notación de Hill):
C6H8
Número de CAS:
628-41-1
Peso molecular:
80.13
Beilstein/REAXYS Number:
1900733
EC Number:
211-043-1
MDL number:
MFCD00001535
UNSPSC Code:
12352100
PubChem Substance ID:
57648333
NACRES:
NA.22

grade

purum

assay

≥97.0% (GC)

form

liquid

contains

~0.2% 2,6-di-tert-butyl-4-methylphenol as stabilizer

refractive index

n20/D 1.472 (lit.)
n20/D 1.473

bp

88-89 °C (lit.)

density

0.847 g/mL at 25 °C (lit.)

SMILES string

C1C=CCC=C1

InChI

1S/C6H8/c1-2-4-6-5-3-1/h1-2,5-6H,3-4H2

InChI key

UVJHQYIOXKWHFD-UHFFFAOYSA-N

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General description

1,4-Cyclohexadiene is an effective hydrogen donor for catalytic hydrogenation reaction. The interaction between graphene segments and 1,4-cyclohexadiene was stuided using density-functional tight-binding (DFTB) method.

Application

1,4-Cyclohexadiene (1,4-CHD) was used to study the formation of parent ion from heavy fragmentation of 1,4-CHD on irradiation with a high-intensity laser pulse.

Other Notes

Reagent for selectively cleaving benzyl esters in the presence of benzyl ethers by catalytic H-transfer

pictograms

FlameHealth hazard
GHS02,GHS08

signalword

Danger

Hazard Classifications

Carc. 1A - Flam. Liq. 2 - Muta. 1B - STOT RE 2

target_organs

Blood

Storage Class

3 - Flammable liquids

wgk_germany

WGK 3

flash_point_f

19.4 °F - closed cup

flash_point_c

-7 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

Certificados de análisis (COA)

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Yan Meng et al.
Nanoscale, 5(24), 12178-12184 (2013-09-24)
To promote possible applications of graphene in molecular identification based on stacking effects, in particular in recognizing aromatic amino acids and even sequencing nucleobases in life sciences, we comprehensively study the interaction between graphene segments and different cyclic organic hydrocarbons
J.S. Bajwa
Tetrahedron Letters, 33, 2299-2299 (1992)
A key factor in parent and fragment ion formation on irradiation with an intense femtosecond laser pulse.
Chemical Physics Letters, 563-570 null
Rapid removal of protecting groups from peptides by catalytic transfer hydrogenation with 1, 4-cyclohexadiene.
The Journal of Organic Chemistry, 43(21), 4194-4196 (1978)
Enrico Tapavicza et al.
Physical chemistry chemical physics : PCCP, 13(47), 20986-20998 (2011-10-25)
We investigate the photodynamics of vitamin D derivatives by a fully analytical implementation of the linear response time-dependent density functional theory surface hopping method (LR-TDDFT-SH). Our study elucidates the dynamics of the processes involved in vitamin D formation at the
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