226319
异氰基乙酸乙酯
95%
别名:
α-异氰基乙酸乙酯, α异氰基乙酸乙酯, (乙氧基羰基)异氰甲烷, 2-乙氧基-2-氧代乙基异氰化物, 2-乙氧基羰甲基异氰化物, 2-异氰基乙酸乙酯, 乙氧基羰甲基异氰化物, 异氰基乙酸乙酯
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关于此项目
线性分子式:
CNCH2COOCH2CH3
化学文摘社编号:
分子量:
113.11
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
221-077-9
Beilstein/REAXYS Number:
3588613
MDL number:
产品名称
异氰基乙酸乙酯, 95%
InChI key
FPULFENIJDPZBX-UHFFFAOYSA-N
InChI
1S/C5H7NO2/c1-3-8-5(7)4-6-2/h3-4H2,1H3
SMILES string
CCOC(=O)C[N+]#[C-]
assay
95%
form
liquid
refractive index
n20/D 1.418 (lit.)
bp
194-196 °C (lit.)
density
1.035 g/mL at 25 °C (lit.)
functional group
amine
ester
isonitrile
storage temp.
2-8°C
Quality Level
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Application
异氰基乙酸乙酯被用于合成7-氮杂-四氢吲哚。它还被用于制备吡咯、噁唑啉、苯二氮卓类、噁唑和咪唑。
General description
异氰酸乙酯是一种异氰酸酯，是生产杂环的合成砌块。
signalword
Warning
hcodes
Hazard Classifications
Acute Tox. 4 Inhalation - Acute Tox. 4 Oral
存储类别
10 - Combustible liquids
wgk
WGK 3
flash_point_f
183.2 °F - closed cup
flash_point_c
84 °C - closed cup
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
法规信息
危险化学品
此项目有
Flow-assisted synthesis of heterocycles via multicomponent reactions
Van MS, et al.
Syntheses of Heterocyclic Compounds. , 133-159 (2018)
Yifei Li et al.
Chemical communications (Cambridge, England), 48(100), 12228-12230 (2012-11-13)
A novel and efficient route for the synthesis of 7-aza-tetrahydroindoles from N-aryl/alkyl-alkenoylacetamides and ethyl isocyanoacetate is described. A mechanism, involving a stepwise [3+2] cycloaddition-intramolecular aza-Michael addition cascade, is proposed that explains the origin of the double nucleophilic attack on the
Tetrahedron Letters, 47, 5481-5481 (2006)
Z Q Gu et al.
Journal of medicinal chemistry, 36(8), 1001-1006 (1993-04-16)
A series of imidazo[1,5-a][1,4]benzodiazepine esters have been synthesized with varying ester side chains and 8-position substituents. The affinities of these compounds were evaluated at both "diazepam-insensitive" (DI) and diazepam-sensitive (DS) subtypes of the benzodiazepine receptor (BZR). A profound steric effect
Chikashi Kanazawa et al.
Journal of the American Chemical Society, 128(33), 10662-10663 (2006-08-17)
The copper-catalyzed reaction between two different isocyanides produces the corresponding heteroaromatization products, imidazoles, in good yields. The reaction proceeds most probably through the activation of the sp3 C-H bond in the isocyanides by a copper catalyst, followed by a [3
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