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Merck
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151815

Sigma-Aldrich

苯-d6

99.6 atom % D

别名:

氘代苯

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About This Item

经验公式（希尔记法）:
C6D6
CAS号:
1076-43-3
分子量:
84.15
Beilstein:
1905426
EC號碼:
214-061-8
MDL號碼:
MFCD00003010
分類程式碼代碼:
12142201
PubChem物質ID:
24849165
NACRES:
NA.11

同位素純度

99.6 atom % D

品質等級

100

化驗

≥99% (CP)

形狀

liquid

expl. lim.

0.34-6.3 % (lit.)

技術

NMR: suitable

雜質

≤0.01% water
water

折射率

n20/D 1.497 (lit.)

bp

79.1 °C/760 mmHg (lit.)

mp

6.8 °C (lit.)

密度

0.950 g/mL at 25 °C (lit.)

質量偏移

M+6

SMILES 字串

[2H]c1c([2H])c([2H])c([2H])c([2H])c1[2H]

InChI

1S/C6H6/c1-2-4-6-5-3-1/h1-6H/i1D,2D,3D,4D,5D,6D

InChI 密鑰

UHOVQNZJYSORNB-MZWXYZOWSA-N

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相关类别

一般說明

苯-d6（C6d6）为苯的氘代衍生物。它是一种NMR（核磁共振）分析的标准纯度溶剂。其Soret系数S（T）已通过瞬态全息光栅技术测定。它的第一个共振拉曼光谱 和红外吸收强度（在5000-450cm-1范围内） 已有报道。苯-d6 可参与同位素标记样品的合成。

應用

苯-d6 可在 1 μ-亚甲基-双（(η5-环戊二烯基羰基钴）（一种桥联亚甲基络合物）的NMR研究中，作为氘代溶剂使用。

推薦產品

请浏览我们全新的在线门户网站ChemisTwin®，用于NMR波谱的定性和定量。了解更多或联系我们免费试用。

訊號詞

Danger

危險分類

Aquatic Chronic 3 - Asp. Tox. 1 - Carc. 1A - Eye Irrit. 2 - Flam. Liq. 2 - Muta. 1B - Skin Irrit. 2 - STOT RE 1

標靶器官

Blood

儲存類別代碼

3 - Flammable liquids

水污染物質分類（WGK）

WGK 3

閃點（°F）

12.2 °F - closed cup

閃點（°C）

-11 °C - closed cup

個人防護裝備

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

分析证书(COA)

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Synthesis and Reactions of a Binuclear Cobalt Bridging Methylene (pCH2) Complex. Conversion to p-CH2 Rh/Co and Rh/Rh Complexes and Methylene Transfer to Ethylene Involving Activation by a Second Metal Complex
Theopold.HK and Bergman.GR
Journal of the American Chemical Society, 103, 2489-2491 (1981)
Resonance Raman scattering of benzene and benzene-d6 with 212.8 nm excitation.
Ziegler LD and Hudson B.
J. Chem. Phys. , 74(2), 982-992 (1981)
Infrared intensities of liquids XXII: Optical and dielectric constants, molar polarizabilities, and integrated intensities of liquid benzene-d6 at 25?C between 5000 and 450 cm-1.
Bertie JE and Keefe CD.
Fresenius Journal of Analytical Chemistry, 362(1), 91-108 (1998)
The conformational distribution in diphenylmethane determined by nuclear magnetic resonance spectroscopy of a sample dissolved in a nematic liquid crystalline solvent.
Celebre G, et al.
J. Chem. Phys., 118(14), 6417-6426 (2003)
G Wittko et al.
The Journal of chemical physics, 123(1), 014506-014506 (2005-07-23)
The Soret coefficients S(T) of the liquids acetone, benzene, benzene-d1, 1,3,5-benzene-d3, benzene-d5, benzene-13C6, benzene-d6, n-hexane, toluene, 1,2,3,4-tetrahydronaphthalene, isobutylbenzene, and 1,6-dibromohexane have been measured in protonated and perdeuterated cyclohexane by a transient holographic grating technique. It has been found that S(T)
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NMR Deuterated Solvent Properties Reference Chart

Use this reference table to find the coupling values and chemical shifts of our NMR (deuterated) solvents. Melting and boiling points, molecular weight, density, and CAS number are also listed.

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