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Merck
CN

49157

2-(2-氰乙基)环己酮

≥97.0%

别名:

2-氧代环己烷丙腈, 3-(2-氧代环己基)丙腈

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关于此项目

经验公式（希尔记法）:
C9H13NO
化学文摘社编号:
4594-78-9
分子量:
151.21
NACRES:
NA.22
PubChem Substance ID:
57651171
UNSPSC Code:
12352100
EC Number:
224-991-6
MDL number:
MFCD00013797
Assay:
≥97.0%

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InChI key

SPTVCXKSSRBTMN-UHFFFAOYSA-N

InChI

1S/C9H13NO/c10-7-3-5-8-4-1-2-6-9(8)11/h8H,1-6H2

SMILES string

O=C1CCCCC1CCC#N

assay

≥97.0%

refractive index

n20/D 1.474

density

1.024 g/mL at 20 °C (lit.)

General description

2-(2-Cyanethyl)cyclohexanone, also known as 3-(2-oxocyclohexyl)propionitrile, is an α-substituted cyclohexanone. It reacts with BrF3(bromine trifluoride) to form the corresponding oxadecaline.

Application

2-(2-Cyanethyl)cyclohexanone may be used in the synthesis of 4-keto-nona-1,9-dioic acid by reacting with hydrogen peroxide.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral

存储类别

10 - Combustible liquids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

历史批次信息供参考:

分析证书(COA)

Lot/Batch Number

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Katritzky AR and Talyor RJK
Comprehensive Organic Functional Group Transformations II, 2986-2986 (2004)
Purich DL
Enzyme Kinetics and Mechanism, Part F, 354, 109-109 (2002)

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