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About This Item
线性分子式:
(CD3)3COD
CAS号:
分子量:
84.18
EC 号:
MDL编号:
UNSPSC代码:
12142201
PubChem化学物质编号:
NACRES:
NA.21
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同位素纯度
99 atom % D
质量水平
方案
99% (CP)
表单
liquid
技术
NMR: suitable
杂质
≤0.5% water
water
折射率
n20/D 1.3835 (lit.)
沸点
82 °C (lit.)
密度
0.893 g/mL at 25 °C (lit.)
应用
pharmaceutical
质量偏移
M+10
SMILES字符串
[2H]OC(C([2H])([2H])[2H])(C([2H])([2H])[2H])C([2H])([2H])[2H]
InChI
1S/C4H10O/c1-4(2,3)5/h5H,1-3H3/i1D3,2D3,3D3,5D
InChI key
DKGAVHZHDRPRBM-SGLLWXCUSA-N
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一般描述
tert-Butanol-d10 (tert-Butyl alcohol-d10) is a deuterated derivative of tert-butanol. It participates in the synthesis of cyanoacetic acid-tert-butylester-d9. Conformational analysis of 2,3-dihydroxypropanoic acid in tert-butyl alcohol-d10 indicates the dominance of gauche-hydroxyl rotamers (92%) under low pH conditions.
应用
tert-Butanol-d10 may be used in the synthesis of cyanoacetic acid-tert-butylester-d9 and tert-butoxide-d9 (BuOK-d9).
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警示用语：
Danger
危险分类
Acute Tox. 4 Inhalation - Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3
靶器官
Central nervous system, Respiratory system
储存分类代码
3 - Flammable liquids
WGK
WGK 1
闪点(°F)
51.8 °F - closed cup
闪点(°C)
11 °C - closed cup
法规信息
危险化学品
Silacyclobutane as ?Carbanion Pump? in Anionic Polymerization. III. Synthesis of Di-and Tri-block Copolymer by ?Diphenylsilacyclobutane-Potassium tert-Butoxide System
Hyun J-Y and Kawakami Y
Polymer Journal, 36(10), 856-865 (2004)
Thorsten W Jaskolla et al.
Journal of the American Society for Mass Spectrometry, 22(6), 976-988 (2011-09-29)
This work experimentally verifies and proves the two long since postulated matrix-assisted laser desorption/ionization (MALDI) analyte protonation pathways known as the Lucky Survivor and the gas phase protonation model. Experimental differentiation between the predicted mechanisms becomes possible by the use
Michael D Drake et al.
Magnetic resonance in chemistry : MRC, 44(3), 210-219 (2006-02-16)
Vicinal (1)H--(1)H coupling constants were used to determine the conformational preferences of 2,3-dihydroxypropanoic acid (1) (DL-glyceric acid) in various solvents and its different carboxyl ionization states. The stereospecific assignments of J(12) and J(13) were confirmed through the point-group substitution of
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