质量水平
方案
97%
表单
powder
包含
1-3% sodium chloride as stabilizer
mp
101-105 °C (lit.)
储存温度
2-8°C
SMILES字符串
O=C1CCCC(=O)C1
InChI
1S/C6H8O2/c7-5-2-1-3-6(8)4-5/h1-4H2
InChI key
HJSLFCCWAKVHIW-UHFFFAOYSA-N
基因信息
human ... ACHE(43), BCHE(590), CES1(1066)
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应用
1,3-环己二酮可作为建构单元，进行以下合成反应：
- 通过醛醇缩合/迈克尔（Michael）加成反应与未活化的醛反应，合成9-取代的1,8-二氧杂蒽。
- 与邻苯二甲酰肼、芳香族炔丙氧基醛和叠氮化物经四组分缩合反应，合成[（1,2,3-三唑-4-基）甲氧基-苯基]-2H-吲唑并[2,1-b]酞嗪-三酮衍生物。
警示用语：
Danger
危险声明
危险分类
Acute Tox. 4 Oral - Aquatic Chronic 3 - Eye Dam. 1
储存分类代码
13 - Non Combustible Solids
WGK
WGK 2
个人防护装备
Eyeshields, Gloves, type N95 (US)
历史批次信息供参考:
分析证书(COA)
Lot/Batch Number
Alkylation of Cyclic 1,3-Diketones
Thennati R, et al.
Synthetic Communications, 23, 3095-3095 (1993)
Reactions of methylated 5-chloro-1,2,3-thiadiazolium salts with cyclohexane-1,3-diones: X-ray crystal structure analysis of the thiapentalenic products
Gerrit L, et al.
Journal of the Chemical Society. Perkin Transactions 1, 3051-3051 (1993)
Combining click-multicomponent reaction: one-pot synthesis of triazolyl methoxy-phenyl indazolo [2, 1-b] phthalazine-trione derivatives
Salehi P, et al.
Molecular Diversity, 16(2), 231-240 (2012)
K7 [PW11CoO40]-catalyzed one-pot synthesis of polyhydroquinoline derivatives via the Hantzsch three component condensation
Heravi MM, et al.
J. Mol. Catal. A: Chem., 264(1-2), 50-52 (2007)
Michael L Neidig et al.
Biochemical and biophysical research communications, 338(1), 206-214 (2005-10-04)
(4-Hydroxyphenyl)pyruvate dioxygenase (HPPD) is an alpha-keto-acid-dependent dioxygenase which catalyzes the conversion of (4-hydroxyphenyl)pyruvate (HPP) to homogentisate as part of tyrosine catabolism. While several di- and tri-ketone alkaloids are known as inhibitors of HPPD and used commercially as herbicides, one such
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