262382
4,4-二甲基-3-氧戊酰氰
99%
别名:
新戊酰基乙腈
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关于此项目
线性分子式:
(CH3)3CCOCH2CN
化学文摘社编号:
分子量:
125.17
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
262-017-1
Beilstein/REAXYS Number:
1746674
MDL number:
InChI key
MXZMACXOMZKYHJ-UHFFFAOYSA-N
InChI
1S/C7H11NO/c1-7(2,3)6(9)4-5-8/h4H2,1-3H3
SMILES string
CC(C)(C)C(=O)CC#N
assay
99%
form
solid
bp
125-126 °C/22 mmHg (lit.)
mp
66-69 °C (lit.)
Application
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
signalword
Danger
hcodes
pcodes
Hazard Classifications
Acute Tox. 3 Oral
存储类别
6.1D - Non-combustible acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
法规信息
新产品
此项目有
John Regan et al.
Journal of medicinal chemistry, 45(14), 2994-3008 (2002-06-28)
We report on a series of N-pyrazole, N'-aryl ureas and their mode of binding to p38 mitogen activated protein kinase. Importantly, a key binding domain that is distinct from the adenosine 5'-triphoshate (ATP) binding site is exposed when the conserved
Phillip J Black et al.
Organic & biomolecular chemistry, 4(1), 116-125 (2005-12-17)
Alcohols have been employed as substrates for C-C bond-forming reactions which involve initial activation by the temporary removal of hydrogen to form an aldehyde. The intermediate aldehyde is converted into an alkene via a Horner-Wadsworth-Emmons reaction, nitroaldol and aldol reactions.
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