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Acetone-d6

氘代丙酮

品牌
Sigma-Aldrich
CAS
666-52-4
货号
175862
规格纯度
"100%", 99.96 atom % D
参考价格
1102.35 *本价格含增值税费
促销
数量
-+
产品介绍:

产品说明

一般描述

Acetone-d6 can be prepared by reacting heavy water with propyne-d4 in the presence of mercury catalyst.
Acetone-d6 (CD3COCD3, Hexadeuteroacetone) is the hexadeuterated form of acetone. It is 100% NMR (Nuclear Magnetic Resonance) solvent. It is widely employed in high resolution NMR studies due to its high chemical and isotopic purity. Absorption spectra of CD3COCD3 samples cooled in molecular jet (jet-cooled) have been evaluated in the range of 51000-54000cm-1. Collision of its molecular ions with a perdeuterated surface (C20D41 SAu) was investigated by ion-surface collision spectroscopy. The Infrared and Raman spectra of acetone-d6 have been analyzed.4 It undergoes H-2H exchange reaction with acetone d0 to afford acetone d1 and d5.

应用

Acetone-d6 has been used as a solvent for the NMR (Nuclear Magnetic Resonance) spectral investigation of (S)-2-(6-((3-((15-carboxypentadecyl)disulfanyl)propoxy)carbonyloxy)benzo[d]thiazol-2-yl)-4,5-dihydrothiazole-4-carboxylic acid.

包装

5 g in ampule
25 g in glass bottle
10×0.5, 10×0.75 mL in ampule

基本信息

线性分子式CD3COCD3
分子量64.12
Beilstein1702935
EC 号211-563-9
MDL编号MFCD00044635
PubChem化学物质编号24850533
NACRESNA.21

产品性质

质量水平100
蒸汽密度2 (vs air)
蒸汽压14.39 psi ( 55 ℃)
184 mmHg ( 20 ℃)
3.67 psi ( 20 ℃)
同位素纯度99.96 atom % D
测定≥99% (CP)
形式liquid
expl. lim.13.2 %
包装ampule of 0.5, 0.75 mL, 5 g
glass bottle of 25 g
technique(s)NMR: suitable
杂质≤0.0500% water
water
折射率n20/D 1.355 (lit.)
bp55.5 ℃ (lit.)
mp−93.8 ℃ (lit.)
密度0.872 g/mL at 25 ℃ (lit.)
质量偏移M+6
SMILES string[2H]C([2H])([2H])C(=O)C([2H])([2H])[2H]
InChI1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3
InChI keyCSCPPACGZOOCGX-WFGJKAKNSA-N

安全信息

象形图GHS02GHS07
警示用语:Danger
危险声明H225 - H319 - H336
预防措施声明P210 - P233 - P240 - P241 - P242 - P305 + P351 + P338
危险分类Eye Irrit. 2 - Flam. Liq. 2 - STOT SE 3
靶器官Central nervous system
补充剂危害EUH066
储存分类代码3 - Flammable liquids
WGKWGK 1
闪点(F)-2.2 °F - closed cup
闪点(C)-19 ℃ - closed cup
个人防护装备Eyeshields, Faceshields, Gloves

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