所有图片(1)
别名:
β-羟基异戊腈
线性分子式:
HOC(CH3)2CH2CN
CAS号:
分子量:
99.13
Beilstein:
1738209
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22
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质量水平
检测方案
≥97.0% (GC)
折射率
n20/D 1.430
bp
114-116 °C/30 mmHg (lit.)
密度
0.959 g/mL at 20 °C (lit.)
储存温度
2-8°C
SMILES字符串
CC(C)(O)CC#N
InChI
1S/C5H9NO/c1-5(2,7)3-4-6/h7H,3H2,1-2H3
InChI key
CWPMDJFBWQJRGT-UHFFFAOYSA-N
一般描述
3-Hydroxy-3-methylbutyronitrile is a β-hydroxynitrile. It undergoes thermal degradation in gas phase via a six-membered cyclic transition state. 3-Hydroxy-3-methylbutyronitrile can be synthesized from 2-hydroxy-2-methyl-1-bromopropane.
应用
3-Hydroxy-3-methylbutyronitrile may be used to synthesize 1,1-dimethylcyanoethyl bromoacetate.
警示用语：
Warning
危险声明
危险分类
Acute Tox. 4 Inhalation - Acute Tox. 4 Oral
WGK
WGK 3
闪点(°F)
closed cup
闪点(°C)
closed cup
个人防护装备
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Elimination kinetics of β-hydroxynitriles in the gas phase.
Chuchani G, et al.
Journal of Physical Organic Chemistry, 12, 19-23 (1999)
Theoretical study of the thermolysis reaction of β-hydroxynitriles in the gas phase.
Chamorro E, et al.
International Journal of Quantum Chemistry, 91(5), 618-625 (2003)
Douglas J Dellinger et al.
Journal of the American Chemical Society, 125(4), 940-950 (2003-01-23)
Phosphonoacetate and thiophosphonoacetate oligodeoxynucleotides were prepared via a solid-phase synthesis strategy. Under Reformatsky reaction conditions, novel esterified acetic acid phosphinodiamidites were synthesized and condensed with appropriately protected 5'-O-(4, 4'-dimethoxytrityl)-2'-deoxynucleosides to yield 3'-O-phosphinoamidite reactive monomers. These synthons when activated with tetrazole
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