チオキサントン

Thioxanthone

HCID 10295CAS 492-22-8

基本情報

標準SMILES
O=c1c2ccccc2sc2ccccc12
InChIKey
YRHRIQCWCFGUEQ-UHFFFAOYSA-N
分子式
C13H8OS
平均分子量
212.27 g/mol
単同位体質量
212.02958588

概要

structure in first source

名称と識別子

優先名称
Thioxanthone
IUPAC
thioxanthen-9-one
現地名
チオキサントン
英語名
Thioxanthen-9-one
分子式
C13H8OS
分子量
212.27

名称と別名

Thioxanthen-9-one492-22-89H-THIOXANTHEN-9-ONEThioxanthone9-ThioxanthoneThiaxanthenoneThioxanthenoneThiaxanthon9H-Thioxanthene, 9-oxo-EOK1SAC304NSC-15912NSC-658181
名称をさらに表示
チオキサントンチオキサンテン-9-オン9H-チオキサンテン-9-オンチアキサントン9H‐チオキサンテン‐9‐オン9-オキソチオキサンテン9-THIOXANTHENONE9-thione1-xanthenone
DTXSID8060082RefChem:189678DTXCID0040674207-749-4ThiaxanthoneThioxanthene-9-one9-Oxothioxanthene10-Thioxanthone

データベース識別子

CAS
492-22-8
PubChem CID
10295
DTXSID
DTXSID8060082
ChEMBL
CHEMBL83371
UNII
EOK1SAC304
EC Number
207-749-4
Nikkaji
J1.555E

物性

構造計算による物性

XLogP
4
極性表面積
42.4 Ų
水素結合供与体数
0
水素結合受容体数
2
回転可能結合数
0
重原子数
15

実験および物理化学的性質

Chemical ClassesOther Classes -> Other Aromatic Compounds
SpringerMaterials PropertiesSchoenflies notation
Vapor Pressure0.0000135 [mmHg]
Physical DescriptionYellow solid; [Merck Index] Light yellow crystalline solid; [Sigma-Aldrich MSDS]

物理化学的性質

融点
210 · 210-213 °C(lit.)
沸点
371 · 371-373 °C715 mm Hg(lit.)
比重(密度)
1.2247 · 1.2247 (rough estimate)
屈折率
1.57 · 1.5700 (estimate)
闪点
371 · 371-373°C/715mm
貯蔵温度
2 · 2-8°C

化学的性質

化学的特性slightly yellow crystalline powder

安全と法規制

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 97.4% (37 of 38) of all reports.

Not Classified

Aggregated GHS information provided per 38 reports by companies from 2 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesNot Classified

安全データ

wgk
3
tsca
TSCA listed
hs_code
29349990
risk_code
36/37/38
化審法
(5)-3672
hazard_code
Xi

化学と産業

用途と製造

General Manufacturing Information9H-Thioxanthen-9-one: ACTIVE
応用分野 · 3 件

用途有機合成原料。

説明Thioxanthone is a heterocyclic compound that is a sulfur analog of xanthone.Thioxanthone can be prepared by the reaction of diphenyl sulfide with phosgene in the presence of catalytic aluminium chloride. This synthesis can be seen as a special case of the Friedel-Crafts acylation. The reduction product is thioxanthene.Thioxanthone dissolves in concentrated sulfuric acid to give a yellow colored liquid with intense green fluorescence. A mixture of the thioxanthone derivatives of 2- and 4-isopropylthioxanthone (ITX) is used in the printing industry. Pharmaceutical drugs that are derivatives of thioxanthone include hycanthone and lucanthone.

使用Thioxanthen-9-one is a reagent and a starting material for the synthesis of Metixene Hydrochloride. It is also used for highly functional group tolerant and chemoselective oxidation of aromatic or aliphatic sulfides to sulfoxides with hydrogen peroxide.

調製方法 · 1 件

純化方法It forms yellow needles from CHCl3 or EtOH and sublimes in vacuo. It is soluble in CS2, hot AcOH, and dissolves in conc H2SO4 to give a yellow colour with green fluorescence in VIS light. The sulfone has m 187o (from EtOH), and the hydrazone has m 115o (yellow leaflets from EtOH/*C6H6). The oxime has m 194-196o (from pet ether). [Szmant et al. J Org Chem 18 745 1953, Ullmann et al. Chem Ber 49 2509 1916, NMR: Sharpless et al. Org Magn Res 6 115 1974, Beilstein 17 H 357, 17 I 191, 17 III/IV 5302, 17/10 V 437.]

サプライヤー50 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
湖北永阔科技有限公司027-59223108 15972152991 · [email protected]
山东旭晨化工科技有限公司0533-15715337262 15715337262 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]

関連反応

22 件

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