146692
2-茚酮
98%
别名:
2-茚满酮
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关于此项目
经验公式（希尔记法）:
C9H8O
化学文摘社编号:
分子量:
132.16
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
210-410-3
Beilstein/REAXYS Number:
636550
MDL number:
产品名称
2-茚酮, 98%
InChI key
UMJJFEIKYGFCAT-UHFFFAOYSA-N
InChI
1S/C9H8O/c10-9-5-7-3-1-2-4-8(7)6-9/h1-4H,5-6H2
SMILES string
O=C1Cc2ccccc2C1
assay
98%
form
solid
impurities
≤2.0% water
mp
51-54 °C (lit.)
functional group
ketone
storage temp.
2-8°C
Quality Level
Gene Information
human ... CYP1A2(1544)
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Application
在茚融合卟啉的合成中， 2-茚酮用作起始试剂 。
General description
2-茚满酮与 CHBr 3 发生 TiCl 4 -Mg 介导的偶联反应，生成二溴甲基甲醇 。它与 5,5-二甲基-3-吡唑烷酮反应生成 5,5-二甲基-2-（1 H -茚基-2）-3-吡唑烷酮 。266 nm 单光子激发下 2-茚满酮的光解反应生成 o -苯二甲基 。
存储类别
11 - Combustible Solids
wgk
WGK 3
flash_point_f
212.0 °F - closed cup
flash_point_c
100 °C - closed cup
ppe
Eyeshields, Gloves, type N95 (US)
Spectroscopic studies on photochemical formation of o-xylylene in solution.
Fujiwara M, et al.
The Journal of Physical Chemistry A, 101(27), 4912-4915 (1997)
Tu-Hsin Yan et al.
Organic letters, 15(22), 5802-5805 (2013-11-07)
TiCl4-Mg can mediate addition of CHBr3 to a variety of aldehydes and ketones to form dibromomethyl carbinols and also be used to effect CBr3 transfer to carbonyl groups to form tribromomethyl carbinols. The successful application of TiCl4-Mg-promoted coupling of CHBr3
Timothy D Lash et al.
The Journal of organic chemistry, 76(13), 5335-5345 (2011-05-24)
Indene-fused porphyrins have been synthesized starting from 2-indanone. Knorr-type reaction of oximes derived from benzyl or tert-butyl acetoacetate with 2-indanone and zinc dust in propionic acid gave good yields of indenopyrroles. Treatment with N-chlorosuccinimide then gave 8-chloro derivatives, and these
Laura E Korhonen et al.
Journal of medicinal chemistry, 48(11), 3808-3815 (2005-05-27)
The purpose of this study was to determine the cytochrome P450 1A2 (CYP1A2) inhibition potencies of structurally diverse compounds to create a comprehensive three-dimensional quantitative structure-activity relationship (3D-QSAR) model of CYP1A2 inhibitors and to use this model to predict the
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