キサントヒドロール (10% メタノール溶液)

Xanthydrol

HCID 72861

基本情報

CAS
90-46-0
標準SMILES
OC1c2ccccc2Oc2ccccc21
InChIKey
JFRMYMMIJXLMBB-UHFFFAOYSA-N
分子式
C13H10O2
平均分子量
198.22 g/mol
単同位体質量
198.06807956

概要

xanthydrol has been reported in Xanthium spinosum and Xanthium strumarium with data available.

名称と識別子

優先名称
Xanthydrol
IUPAC
9H-xanthen-9-ol
現地名
キサントヒドロール (10% メタノール溶液)
英語名
9-Hydroxyxanthene
分子式
C13H10O2
分子量
198.22

名称と別名

9-HydroxyxantheneXanthydrol9H-Xanthen-9-ol90-46-0Xanthen-9-ol9-Xanthydrol7131M69IKFNSC-4038DTXSID8059009RefChem:902268DTXCID9048691201-996-1
名称をさらに表示
キサントヒドロール (10% メタノール溶液)9H-キサンテン-9-オール9-ヒドロキシ-9H-キサンテン9-キサンテノールキサンチドロールキサントヒドロール9-ヒドロキシキサンテンキサントヒドロール10%メタノール溶液キサントヒドロール (10%メタノール溶液)9-ヒドロキシキサンテン (10%メタノール溶液)9‐ヒドロキシキサンテンキサントドロール9-キサンチドロールXanthene-9-OLXANTHYDROL(RG)Xanthydrol 98%
Xanthanol9-XanthenolXanthene, hydroxy-MFCD00005057CHEMBL5204890CCRIS 1640NSC 4038EINECS 201-996-1

データベース識別子

CAS
90-46-0
PubChem CID
72861
DTXSID
DTXSID8059009
ChEMBL
CHEMBL5204890
UNII
7131M69IKF
EC Number
201-996-1
Nikkaji
J4.318D

物性

構造計算による物性

XLogP
1.9
極性表面積
29.5 Ų
水素結合供与体数
1
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 PropertiesChemical shift
Physical DescriptionBeige powder; [Sigma-Aldrich MSDS]

物理化学的性質

融点
122 · 122-124 °C
沸点
275.53 °C · 275.53°C (rough estimate)
比重(密度)
0.83 g/mL · 0.83 g/mL at 20 °C
屈折率
1.662 · 1.6620 (estimate)
闪点
11 °C · 11 °C
貯蔵温度
2 · 2-8°C

化学的性質

化学的特性White needle crystals. Melting point 123℃, easily soluble in cold acetone, soluble in alcohol, chloroform, very slightly soluble in water. Dissolved in concentrated sulfuric acid, it is yellow and has green fluorescence.

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory InformationChemical: 9H-Xanthen-9-ol
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS]
Hazard Classes and CategoriesAcute Tox. 4 (50%)

安全データ

F
8-10-23
wgk
3
tsca
TSCA listed
rtecs
ZD5710000
ridadr
UN 1230 3/PG 2
hs_code
29329990

化学と産業

用途と製造

General Manufacturing Information9H-Xanthen-9-ol: INACTIVE
応用分野 · 2 件

使用9-Hydroxyxanthene is an Intermediate in the preparation of Propantheline Bromide. It is useful in tests for urea also used in the protection of thiols as their S-xanthenyl (Xan) thioethers, by reaction in the presence of TFA.

一般的な説明Xanthydrol is also known as 9H-xanthen-9-ol. Xanthydrol is a natural drug that has been used in traditional Chinese medicine for treating a variety of diseases. It is extracted from Rhizoma Gastrodiae and Angelicae Dahuricae. It has shown to be effective against various metabolic disorders, including insulin resistance, hyperlipidemia, and diabetes. The mechanism of action of Xanthydrol is not known but it is thought to be due to its ability to activate the immune system by transferring reactions and promoting the production of antibodies. It also shows anti-inflammatory effects by inhibiting the production of prostaglandins and leukotrienes. It can also inhibit angiotensin II, which may reduce high blood pressure and congestive heart failure.

調製方法 · 2 件

製造方法synthesis of xanthydrol: The amalgam sodium in dry toluene was warmed to 50°C, the xanthone-ethanol suspension was added, and the temperature was rapidly raised to 60-70°C with vigorous stirring. After the reaction is completed, the mercury is separated. The reaction solution was filtered, the filtrate was poured into the stirred blue distilled water, the 9-hydroxyxanthene was filtered out, washed with water, and dried to obtain the finished product with a yield of 91-95%.

純化方法Crystallise xanthydrol from EtOH and dry it at 40-50o. [Beilstein 17 H 129, 17 I 72, 17 II 146, 17 III/IV 1602, 17/4 V 502.]

サプライヤー100 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
艾吉析科技(上海)有限公司17717235263 · [email protected]
毕佳索(上海毕得医药科技股份有限公司)400-6005915 · [email protected]
杭州品高化工有限公司0571-87658025 · [email protected]

補足説明

定義9H-Xanthen-9-ol is a derivative of xanthene that is a natural product found in Xanthium spinosum and Xanthium strumarium.

関連反応

27 件

化合物ノート

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