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Merck
CN

615803

环己烷-d11

98 atom % D

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关于此项目

经验公式(希尔记法):
C6D11H
分子量:
95.23
UNSPSC Code:
12142201
PubChem Substance ID:
MDL number:


isotopic purity

98 atom % D

bp

81 °C (lit.)

mp

6-7 °C (lit.)

density

0.879 g/mL at 25 °C

mass shift

M+11

SMILES string

[2H]C1C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C1([2H])[2H]

InChI

1S/C6H12/c1-2-4-6-5-3-1/h1-6H2/i1D,2D2,3D2,4D2,5D2,6D2

InChI key

XDTMQSROBMDMFD-WTVBDOPLSA-N

General description

Cyclohexane-d11 is a deuterated species of cyclohexane. It is employed in obtaining the rate of ring inversion process during the conformational analysis of cyclohexane by NMR. The Raman spectra of cyclohexane-d11 in various solvents have been recorded to study the gas-to-liquid frequency shifts and isotropic Raman linewidths.

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.


signalword

Danger

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Asp. Tox. 1 - Flam. Liq. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Central nervous system

存储类别

3 - Flammable liquids

wgk

WGK 2

flash_point_f

-4.0 °F - closed cup - (in analogy to similar products)

flash_point_c

-20 °C - closed cup - (in analogy to similar products)

法规信息

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分析证书(COA)

Lot/Batch Number

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Nuclear Magnetic Resonance Line-Shape and Double-Resonance Studies of Ring Inversion in Cyclohexane-d11.
Anet FAL and Bourn AJR.
Journal of the American Chemical Society, 89(4), 760-768 (1967)
Solvent-solute interactions and the Raman CH stretching spectrum of cyclohexane- d11: I. Solvent-dependence.
Remar GJ and MacPhail RA.
J. Chem. Phys. , 103(11), 4381-4392 (1995)