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CAS: 59997-51-2
分子式: C7H11NO
分子量: 125.17
沸点: 125-126 °C
熔点: 66-72℃
中文名称: 
三甲基乙酰腈
新戊酰基乙腈
氰代频那酮
氰基频那酮
英文名称: 
Trimethylacetylacetonitrile
4,4-Dimethyl-3-oxo-n-valeronitrile
4,4-Dimethyl-3-oxo-pentanenitrile
4,4-dimethyl-3-oxopentanenitrile
4,4-dimethyl-3-oxo-pentanenitril
pivaloylacetonitrile
4,4-dimethyl-3-oxo-valeronitril
用途: 用作有机合成中间体
推荐供应商
货号品牌产品名称规格包装、参考价格
P824539MACKLIN三甲基乙酰丙酮腈98%30元/25g;   55元/100g;   245元/500g;   1201元/2.5kg;   咨询
储存:室温,干燥,密封
状态:白色到灰白色或棕褐色晶体或结晶粉末
折射率:1.424
P1112TCIPivaloylacetonitrile>98.0%(GC)190元/25G;   2610元/500G;   咨询

基本信息

纯度/分析方法>98.0%(GC)
分子式/分子量C7H11NO = 125.17
外观与形状(20℃)固体
应避免的情况
Reaxys-RN1746674
PubChem物质ID87575217
SDBS (AIST Spectral DB)11723
MDL编号MFCD00010208

技术规格

AppearanceWhite to Almost white powder to crystal
Purity(GC)min. 98.0 %
Melting point67.0 to 70.0 ℃

物性(参考值)

熔点68 ℃
沸点126 ℃/15 mmHg
水溶性实际上不溶
溶解性(可溶于)甲醇,丙酮

安全信息

图形或危害标志
信号词危险
危险性说明H301 : 吞咽会中毒。
H315 : 造成皮肤刺激。
H319 : 造成严重眼刺激。
防范说明P501 : 将内装物/容器送到批准的废物处理厂处理。
P270 : 使用本产品时不要进食、饮水或吸烟。
P264 : 作业后彻底清洗皮肤。
P280 : 戴防护手套/戴防护眼罩/戴防护面具。
P302 + P352 : 如皮肤沾染:用水充分清洗。
P337 + P313 : 如仍觉眼刺激:求医/就诊。
P305 + P351 + P338 : 如进入眼睛:用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出,取出隐形眼镜。继续冲洗。
P362+P364 : 脱掉沾污的衣服,清洗后方可重新使用。
P332 + P313 : 如发生皮肤刺激:求医/就诊。
P301 + P310 + P330 : 如误吞咽:立即呼叫急救中心/医生。漱口。
P405 : 存放处须加锁。

相关法规

RTECS#SA2991000

运输信息

UN编号UN3439
类别6.1
包装类别 III
监管条件代码(*)
111462J&KPivaloylacetonitrile98%116元/25G;   233元/100G;   860元/500G;   咨询

基本信息

分子式C7H11NO
分子量125.17
熔点66-69
沸点125-126
MDL编码MFCD00010208
Beilstein1746674
EINECS 编号262-017-1

安全信息

图形或危害标志
提示语Danger
危险说明H301
防范说明P301+P310
UN号码3439
危险分类6.1
包装等级III
WGK3
RTECSSA2991000
TSCA
A16309Alfa AesarTrimethylacetylacetonitrile97%1380元/25g;   4388元/100g;   18579元/500g;   咨询

应用
Trimethylacetylacetonitrile is a useful intermediate. 4,4-Dimethyl-3-oxopentanenitrile has been used in the preparation of 4,4-dimethyl-3-oxo-2-benzylpentanenitrile, 4,4-dimethyl-3-oxo-2-(4-hydroxybenzyl)pentanenitrile, 4,4-dimethyl-3-oxo-2-(4-methoxybenzyl)pentanenitrile, 4,4-dimethyl-3-oxo-2-(4-fluorobenzyl)pentanenitrile, 4,4-dimethyl-3-oxo-2-(3,4-methylenedioxybenzyl)pentanenitrile, 1-(5-tert-butyl-2-p-tolyl-2H-pyrazol-3-yl)-3-phenylurea.

备注
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Store away from strong oxidizing agents, bases.

基本信息

MDL
MFCD00010208

EINECS
262-017-1

分子式
C7H11NO

分子量
125.17

熔点
66-70°

灵敏度
Ambient temperatures.

形态
Crystalline powder

溶解性
Insoluble in water.

Beilstein
1746674

GHS危害和防范说明

GHS符号

Hazard Statements
H301
Toxic if swallowed.

Precautionary Statements
P264-P270-P301+P310a-P321-P405-P501a
Wash thoroughly after handling.Do not eat, drink or smoke when using this product.Do not eat, drink or smoke when using this product.Specific treatment (see label).Store locked up.Dispose of contents/container in accordance with local/regional/national/international regulations.

安全信息

危险等级
6.1

包装组
III

危险类别
22
Harmful if swallowed.

安全等级
36
Wear suitable protective clothing.

欧盟危险品标志

RTECS
SA2991000

TSCA

C41802Alfa AesarPivaloylacetonitrile97%631元/25g;   2841元/100g;   9643元/500g;   咨询

基本信息

Ref#
41802

MDL
10208

分子式
C7 H11 N O

分子量
125.17

安全信息

UN#
3439

危险等级
6.1

包装组
III

021523Fluorochem4,4-Dimethyl-3-oxo-pentanenitrile99%220元/1g;   308元/25g;   528元/100g;   1078元/250g;   咨询

基本信息

CAS Number59997-51-2
MDL NumberMFCD00010208
Melting Point68-71℃

安全信息

图形或危害标志
危险性说明 H315: Causes skin irritation.
H319: Causes serious eye irritation.
H335: May cause respiratory irritation.
H302 + H312 + H332: Harmful if swallowed, in contact with skin or if inhaled
防范说明 P233: Keep container tightly closed.
P260: Do not breathe .
P261: Avoid breathing .
P264: Wash hands thoroughly after handling.
P270: Do not eat, drink or smoke when using this product.
P271: Use only outdoors or in a well-ventilated area.
P280: Wear .
P301 + P312: IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.
P302 + P352: IF ON SKIN: Wash with plenty of soap and water.
P304: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing..
P304 + P340: IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P305 + P351 + P338: IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P312: Call a POISON CENTER or doctor/physician if you feel unwell.
P321: Specific treatment (see relevant procedures. on this label).
P322: Specific measures (see . on this label).
P330: Rinse mouth.
P332 + P313: If skin irritation occurs: Get medical advice/ attention.
P337 + P313: If eye irritation persists: Get medical advice/attention.
P340: Remove victim to fresh air and keep at rest in a position comfortable for breathing.
P362: Take off contaminated clothing and wash before reuse.
P363: Wash contaminated clothing before reuse.
P403: Store in a well-ventilated place.
P403 + P233: Store in a well-ventilated place. Keep container tightly closed.
P405: Store locked up.
P501: Dispose of contents/container to in accordance with local regulation .
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