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Merck
CN

191639

Sigma-Aldrich

2,4,6-三甲基苄醇

99%

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线性分子式:
(CH3)3C6H2CH2OH
CAS号:
分子量:
150.22
EC 号:
MDL编号:
UNSPSC代码:
12352100
PubChem化学物质编号:
NACRES:
NA.22

检测方案

99%

形式

solid

bp

140 °C/15 mmHg (lit.)

mp

87-89 °C (lit.)

SMILES字符串

Cc1cc(C)c(CO)c(C)c1

InChI

1S/C10H14O/c1-7-4-8(2)10(6-11)9(3)5-7/h4-5,11H,6H2,1-3H3

InChI key

LODDFDHPSIYCTK-UHFFFAOYSA-N

一般描述

2,4,6-Trimethylbenzyl alcohol undergoes oxidation in the presence of molecular iodine and potassium carbonate in 2,2,2-trifluoroethanol.

应用

2,4,6-Trimethylbenzyl alcohol was used in the synthesis of 3-(2,4,6-trimethylbenzyl)indole.

WGK

WGK 2

闪点(°F)

Not applicable

闪点(°C)

Not applicable

个人防护装备

Eyeshields, Gloves, type N95 (US)

法规信息

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H G Shertzer et al.
Archives of toxicology, 70(12), 830-834 (1996-01-01)
Many dietary constituents, such as indole-3-carbinol, are chemoprotective in toxicity and carcinogenicity bioassays. Indole-3-carbinol and related congeners appear to protect partly via radical and electrophile scavenging. To develop better chemoprotective indoles with lower intrinsic toxicity, we performed molecular graphic and
Facile oxidative conversion of alcohols to esters using molecular iodine.
Mori N and Togo H.
Tetrahedron, 61(24), 5915-5925 (2005)

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