半岛bd体育手机客户端 说明

一般描述

Acetone-d₆can be prepared by reacting heavy water with propyne-d₄in 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 CD₃COCD₃samples 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 (C₂₀D₄₁SAu) was investigated by ion-surface collision spectroscopy.The Infrared and Raman spectra of acetone-d₆have been analyzed.4 It undergoes H-²H exchange reaction with acetone d₀to afford acetone d₁and d₅.

应用

Acetone-d₆has 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
Beilstein	1702935
EC 号	211-563-9
MDL编号	MFCD00044635
PubChem化学物质编号	24850533
NACRES	NA.21

半岛bd体育手机客户端 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	n 20/D 1.355 (lit.)
bp	55.5 ℃ (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]
InChI	1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3
InChI key	CSCPPACGZOOCGX-WFGJKAKNSA-N

安全信息

象形图
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
WGK	WGK 1
闪点(F)	-2.2 °F - closed cup
闪点(C)	-19 ℃ - closed cup
个人防护装备	Eyeshields, Faceshields, Gloves