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Merck
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文件

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。

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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)
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)
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)
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)
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)
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