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オクタデカン酸ジヒドロキシアルミニウム

Aluminum Monostearate

HCID 10246924
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
7047-84-9
標準SMILES
CCCCCCCCCCCCCCCCCC(=O)[O-].[Al+3].[OH-].[OH-]
InChIKey
UGMCXQCYOVCMTB-UHFFFAOYSA-K
分子式
C18H37AlO4
平均分子量
344.5 g/mol
単同位体質量
344.2507231

概要

Aluminium monostearate is a salt of stearic acid and aluminium with the molecular formula Al(OH)2C18H35O2. Also known as dihydroxyaluminium or dihydroxy(stearato)aluminium, it is used to form gels in the packaging of pharmaceuticals and in the preparation of colors for cosmetics. While considered safe for use, extensive usage may result in aluminum accumulation.

名称と識別子

優先名称
Aluminum Monostearate
IUPAC
aluminum;octadecanoate;dihydroxide
現地名
オクタデカン酸ジヒドロキシアルミニウム
英語名
ALUMINUM MONOSTEARATE
分子式
C18H37AlO4
分子量
344.47

名称と別名

Aluminum, monostearateAluminum stearate 300Dibasic aluminium stearateAluminium, dihydroxide stearateAluminum, dihydroxy(octadecanoato-O-)-Aluminum, dihydroxide stearateDTXCID9028623CHEBI:31197ALUMINUM MONOPALMITOSTEARATEdihydroxido(octadecanoato)aluminiumP9BC99461E(octadecanoyloxy)alumanylidene dihydrate
名称をさらに表示
モノステアリン酸アルミニウムオクタデカン酸ジヒドロキシアルミニウムジヒドロキシアルミニウムオクタデカノアートステアリン酸アルミニウム,モノアルミニウム=ジヒドロキシドステアラートオクタデカン酸アルミニウムステアリン酸アルミニウム.モノステアリン酸アルミニウム, モノモノステアリン酸アルミニウム (JP17)uminum monostearateALUMINUM MONOSTEARATAlminum monostearatreALUMINUM STEARATE MONOALUMINUMMONOSTEARATE,NFdibasicaluminumstearateALUMINIUM STEARATE, MONODihydroxyaluminumstearateALUMINIUMSTEARATE(DIBASIC)
RefChem:5566663A60N020Z7230-325-57047-84-9Aluminium monostearateAluminum MonostearateDibasic aluminum stearateDihydroxy(stearato)aluminium

物性

構造計算による物性

極性表面積
42.1 Ų
水素結合供与体数
2
水素結合受容体数
4
回転可能結合数
15
重原子数
23
形式電荷
0
複雑度
196

実験および物理化学的性質

CosmeticsCosmetic colorant; Anticaking
Animal DrugsPharmaceuticals -> UK Veterinary Medicines Directorate List
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

物理化学的性質

融点
155 ℃ · 155℃ [PFA93]
比重(密度)
1.02 · 1.020
溶解性
水にほとんど溶けない。エタノール (95%) とベンゼンに可溶。
外見
粉
色
yellow-white
水溶解度
2 O;脂肪族および芳香族炭化水素とゲルを形成する · 不溶性H2O;脂肪族および芳香族炭化水素とゲルを形成する [HAW93]
化粧品成分の機能
粘度制御固結防止乳化安定剤着色剤
InChI
InChI=1S/C18H36O2.Al.2H2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;;;/h2-17H2,1H3,(H,19,20);;2*1H2/q;+3;;/p-3
InChIKey
UGMCXQCYOVCMTB-UHFFFAOYSA-K
SMILES
C(CCC(=O)O[Al](O)O)CCCCCCCCCCCCCC
LogP
8.216 · 8.216 (est)
CAS データベース
7047 · 7047-84-9(CAS DataBase Reference)

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 3 件

This chemical does not meet GHS hazard criteria for 100% (24 of 24) of all reports.

Not Classified

Aggregated GHS information provided per 24 reports by companies from 1 notifications to the ECHA C&L Inventory.

危険有害性情報

Regulatory Information · 2 件

Chemical: Aluminium, dihydroxy(octadecanoato-O)-

Aluminium monostearate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesNot Classified

安全と保護具

Minimum Risk LevelIntermediate Oral: 1.0 mg/kg/day (L134) Chronic Oral: 1.0 mg/kg/day (L134)

毒性情報

Health Effects · 1 件

Aluminum targets the nervous system and causes decreased nervous system performance and is associated with altered function of the blood-brain barrier. The accumulation of aluminum in the body may cause bone or brain diseases. High levels of aluminum have been linked to Alzheimer's disease. A small percentage of people are allergic to aluminium and experience contact dermatitis, digestive disorders, vomiting or other symptoms upon contact or ingestion of products containing aluminium. (L739, L740)

Exposure RoutesOral (L739) ; inhalation (L739)
Toxicity Summary · 1 件

The main target organs of aluminum are the central nervous system and bone. Aluminum binds with dietary phosphorus and impairs gastrointestinal absorption of phosphorus. The decreased phosphate body burden results in osteomalacia (softening of the bones due to defective bone mineralization) and rickets. Aluminum's neurotoxicity is believed to involve several mechanisms. Changes in cytoskeletal protein functions as a results of altered phosphorylation, proteolysis, transport, and synthesis are believed to be one cause. Aluminum may induce neurobehavioral effects by affecting permeability of the blood-brain barrier, cholinergic activity, signal transduction pathways, lipid peroxidation, and impair neuronal glutamate nitric oxide-cyclic GMP pathway, as well as interfere with metabolism of essential trace elements because of similar coordination chemistries and consequent competitive interactions. It has been suggested that aluminum's interaction with estrogen receptors increases the expression of estrogen-related genes and thereby contributes to the progression of breast cancer (A235), but studies have not been able to establish a clear link between aluminum and increased risk of breast cancer (A15468). Certain aluminum salts induce immune responses by activating inflammasomes. (L739, A235, A236)

化学と産業

薬理情報

Mechanism of Action · 1 件

Antacids perform a neutralization reaction, ie. they buffer gastric acid, raising the pH to reduce acidity in the stomach. When gastric hydrochloric acid reaches the nerves in the gasitrointestinal mucosa, they signal pain to the central nervous system. This happens when these nerves are exposed, as in peptic ulcers. The gastric acid may also reach ulcers in the esophagus or the duodenum. Other mechanisms may contribute, such as the effect of aluminum ions inhibiting smooth muscle cell contraction and delaying gastric emptying. Aluminum is known to bind troponin C (a muscle protein) and to interfere with voltage-dependent calcium transport. Aluminum also binds to and inhibits the activity of mitochondrial voltage gated channels (VDAC).

Metabolism/Metabolites · 1 件

Aluminum is poorly absorbed following either oral or inhalation exposure and is essentially not absorbed dermally. The bioavailability of aluminum is strongly influenced by the aluminum compound and the presence of dietary constituents which can complex with aluminum and enhance or inhibit its absorption. Aluminum binds to various ligands in the blood and distributes to every organ, with highest concentrations found in bone and lung tissues. In living organisms, aluminum is believed to exist in four different forms: as free ions, as low-molecular-weight complexes, as physically bound macromolecular complexes, and as covalently bound macromolecular complexes. Absorbed aluminum is excreted principally in the urine and, to a lesser extent, in the bile, while unabsorbed aluminum is excreted in the faeces. (L739)

用途と製造

UsesAluminium monostearate is used to form gels in the packaging of pharmaceuticals, and in the preparation of colors for cosmetics. (L763)
Household ProductsInformation on 9 consumer products that contain Aluminum monostearate in the following categories is provided:
Use ClassificationCosmetics -> Cosmetic colorant; Anticaking

応用分野

関連反応

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化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート

データベース識別子

CAS
7047-84-9
PubChem CID
10246924
DTXSID
DTXSID9048697
UNII
P9BC99461E
EC Number
230-325-5
Nikkaji
J227.350K
EPAの化学物質情報
Aluminum, dihydroxy(octadecanoato-.kappa.O)- (7047-84-9)
化学的性質 · 1 件

化学的特性Aluminum monostearate is an aluminum compound of stearic acid and palmitic acid. The USP32–NF27 states that aluminum monostearate contains the equivalent of not less than 14.5% and not more than 16.5% of Al2O3, calculated on the dried basis. The JP XV states that it contains not less than 7.2% and not more than 8.9% of aluminium. Aluminum monostearate occurs as a white, fine, bulky powder with a slight odor of fatty acid. It is a solid material.

Signs and Symptoms · 1 件

Inhalating aluminum dust causes coughing and abnormal chest X-rays. A small percentage of people are allergic to aluminium and experience contact dermatitis, digestive disorders, vomiting or other symptoms upon contact or ingestion of products containing aluminium. (L739, L740)

Carcinogen Classification · 1 件

Not listed by IARC. IARC classified aluminum production as carcinogenic to humans (Group 1), but did not implicate aluminum itself as a human carcinogen. (L135) A link between use of aluminum-containing antiperspirants and increased risk of breast cancer has been proposed (A235), but studies have not been able to establish a clear link (A15468).

安全データ

wgk
3
tsca
TSCA listed
rtecs
BD0707000
ストレージクラス
11 - Combustible Solids

用途正塩が最も多く用いられ、また潤滑剤に用いられている。ロウソクの硬化剤および流滴防止剤、紡織品防水剤、石材、セメント防水剤、防水塗料、塗料の浸透防止剤、塗面ツヤ消シ剤、顔料沈降防止剤。

使用Paints, inks, greases, waxes, thickening lubricating oils; waterproofing, gloss producer, stabilizer for plastics, food additive.

調製方法

Aluminum monostearate is prepared by reacting aluminum with stearic acid.

上流・下流製品情報

上流原料

アルミニウムステアリン酸

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補足説明

定義本品は、ステアリン酸(*)のアルミニウム塩であり、次の化学式で表される。参照表示名称:ステアリン酸

定義A complex containing aluminum and dextran, a chain of molecular weight 2500, corresponding to a chain of 15 anhydroglucose units.