67751-23-9 (4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮,4-Dimethylamino-1,1-dimethoxybut-3-en-2-one)

快速询单

结构式：

4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮MOL文件

CAS号：

67751-23-9

中文名称：

4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮

英文名称：

4-Dimethylamino-1,1-dimethoxybut-3-en-2-one

分子式：

C₈H₁₅NO₃

分子量：

173.209602594376

4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮(67751-23-9)名称与标识符

名称

中文别名：

1,1-二甲氧基-4-甲基氨-3-丁烯-2-酮;4-(二甲氨基)-1,1-二甲氧基-3-丙烯-1-酮;4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮;4-二甲基氨基-1,1-二甲氧基丁-3-烯-2-酮;

英文别名：

4-(Dimethylamino)-1,1-dimethoxybut-3-en-2-one;BUTTPARK 43\57-38;1,1-DIMETHOXY-4-DIMETHYLAMINOBUT-3-EN-2-ONE;4-Dimethylamino-1,1-dimethoxybut-3-en-2-one;E-1,1-Dimethoxy-4-dimethylaminobut-3-en-2-one;(3E)-4-(dimethylamino)-1,1-dimethoxybut-3-en-2-one;(E)-4-(dimethylamino)-1,1-dimethoxybut-3-en-2-one;(E)-dimethylamino-1,1-dimethoxy-but-3-en-2-one;[(1E)-4,4-Dimethoxy-3-oxobut-1-en-1-yl]dimethylamine;1,1-Dimethoxy-2-oxo-4-dimethylamino-3-butene;4-(Dimethylamino)-1,1-dimethoxy-3-buten-2-one;BUTTPARK 4357-38;4-Dimethylamino-1,1-dimethoxy-3-butene-2-one;(4,4-dimethoxy-3-oxobut-1-en-1-yl)dimethylamine;AK116826;HcvL@NBfRYYUffjjAFP;DFZIBCAWOSFLFR-AATRIKPKSA-N;SBB056497;0438AC;KM113;

标识符

MDL：

MFCD00085024

InChIKey：

DFZIBCAWOSFLFR-AATRIKPKSA-N

Inchi：

1S/C8H15NO3/c1-9(2)6-5-7(10)8(11-3)12-4/h5-6,8H,1-4H3/b6-5+

SMILES：

O(C)C(C(/C=C/N(C)C)=O)OC

4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮(67751-23-9)物化性质

实验特性

LogP : 0.24970
PSA : 38.77000
沸点 : 128-131 ºC (0.8 Torr)
闪点 : 81.6±27.3 ºC,
溶解度 : 易溶 (341 g/L) (25 ºC),
密度 : 1.008±0.06 g/cm3 (20 ºC 760 Torr),

计算特性

精确分子量 : 173.10500
氢键供体数量 : 0
氢键受体数量 : 4
可旋转化学键数量 : 5
重原子数量 : 12
复杂度 : 162
疏水参数计算参考值（XlogP） : 0.2
拓扑分子极性表面积 : 38.8

4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮(67751-23-9)安全信息

4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮(67751-23-9)海关数据

海关编码：

2922509090

海关数据：

中国海关编码：

2922509090

概述：

2922509090. 其他氨基醇酚、氨基酸酚及其他含氧基氨基化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件：AB. 最惠国关税:6.5%. 普通关税:30.0%

申报要素：

品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装

监管条件：

A.入境货物通关单
B.出境货物通关单

检验检疫类别：

R.进口食品卫生监督检验
S.出口食品卫生监督检验

Summary：

2922509090. other amino-alcohol-phenols, amino-acid-phenols and other amino-compounds with oxygen function. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮(67751-23-9)上下游

4-二甲氧甲基-2-甲基硫代嘧啶 2-甲基氨基嘧啶-4-羧醛二甲基乙缩醛 1 -甲基- 1H-吡唑- 3 -甲醛 1-甲基-1H-吡唑-5-甲醛 N,N-二甲基甲酰胺二甲缩醛叔丁氧基二(二甲基氨基)甲烷

4-(二甲基氨基)-1,1-二甲氧基-3-丁烯-2-酮(67751-23-9) MSDS

基础信息

Name:	4-(Dimethylamino)-1,1-dimethoxybut-3-en-2-one, 95+% Material Safety Data Sheet
Synonym:
CAS:	67751-23-9

Section 1 - Chemical Product MSDS Name: 4-(Dimethylamino)-1,1-dimethoxybut-3-en-2-one, 95+% Material Safety Data Sheet
Synonym:

SECTION 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
67751-23-9	4-(Dimethylamino)-1,1-dimethoxybut-3-e	95+%	unlisted

+++++
Hazard Symbols: XI

SECTION 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Irritating to eyes, respiratory system and skin.Moisture sensitive. Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes respiratory tract irritation. May be harmful if inhaled.
Chronic:
Not available.

SECTION 4 - FIRST AID MEASURES
Eyes:
Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:
Treat symptomatically and supportively.

SECTION 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use foam, dry chemical, or carbon dioxide.

SECTION 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container.

SECTION 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container. Store under an inert atmosphere.

SECTION 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 67751-23-9: Personal Protective Equipment
Eyes:
Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

SECTION 9 - PHYSICAL AND CHEMICAL PROPERTIES
Physical State: Viscous liquid
Color: yellow - red
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C8H15NO3
Molecular Weight: 173

SECTION 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials, exposure to moist air or water.
Incompatibilities with Other Materials:
Oxidizing agents, acids, bases, amines.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

SECTION 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 67751-23-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
4-(Dimethylamino)-1,1-dimethoxybut-3-en-2-one - Not listed by ACGIH, IARC, or NTP.

SECTION 12 - ECOLOGICAL INFORMATION

SECTION 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations.

SECTION 14 - TRANSPORT INFORMATION IATA No information available. IMO No information available. RID/ADR No information available.

SECTION 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 37/39 Wear suitable gloves and eye/face protection. WGK (Water Danger/Protection) CAS# 67751-23-9: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 67751-23-9 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 67751-23-9 is not listed on the TSCA inventory. It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
MSDS Creation Date: 6/10/2003 Revision #0 Date: Original. The information above is believed to be accurate and represents the best information currently available to us. However, we make no warranty of merchantability or any other warranty, express or implied, with respect to such information, and we assume no liability resulting from its use. Users should make their own investigations to determine the suitability of the information for their particular purposes. In no way shall the company be liable for any claims, losses, or damages of any third party or for lost profits or any special, indirect, incidental, consequential or exemplary damages, howsoever arising, even if the company has been advised of the possibility of such damages.

SECTION 16 - ADDITIONAL INFORMATION
N/A