基本情報
- CAS
110-25-8- 標準SMILES
CCCCCCCC/C=C\CCCCCCCC(=O)N(C)CC(=O)O- InChIKey
DIOYAVUHUXAUPX-KHPPLWFESA-N- 分子式
- C21H39NO3
- 平均分子量
- 353.5 g/mol
- 単同位体質量
- 353.29299411
概要
Oleoyl sarcosine is a N-acyl-amino acid.
名称と識別子
- 優先名称
- Oleoyl Sarcosine
- IUPAC
- 2-[methyl-[(Z)-octadec-9-enoyl]amino]acetic acid
- 現地名
- N-オレオイルサルコシン
- 英語名
- N-OLEOYLSARCOSINE
- 分子式
- C21H39NO3
- 分子量
- 353.54
名称と別名
Oleoyl sarcosineOleyl sarcosineN-Oleoylsarcosine110-25-8OleoylsarcosineN-Methyl-N-oleoylglycineOleic sarcosineSarkosyl OHamposyl OMaprosyl OOleyl N-methylglycineSarcosine, N-oleoyl-
名称をさらに表示
N-オレオイルサルコシンオレオイルザルコシンオレオイルサルコシンN-メチル-N-[(Z)-1-オキソ-9-オクタデセニル]アミノ酢酸N-(カルボキシメチル)-N-メチルオレインアミド3-(オレオイル)-3-アザブタン酸N-メチル-N-[(Z)-1-オキソ-9-オクタデセン-1-イル]アミノ酢酸N-オレオイル-N-メチルグリシンN-メチル-N-オレオイルグリシンN-メチル-N-(カルボキシメチル)オレインアミド[(9-オクタデセノイル)(メチル)アミノ]酢酸N-メチル-N-(1-オキソ-9-オクタデセニル)グリシンオレオイル(メチル)アミノ酢酸N-メチル-N-[(Z)-1-オキソ-9-オクタデセニル]グリシンN-OLEYL SARCOSINEN-Methyloleamidoacetic acid(Z)-N-methyl-N-(1-oxo-9-octadecenyl)glycineOleic acid sarcosineN-Oleoyl sarcosine acidN-CIS-9-OCTADECANOYLSARCOSINE2-(N-MethyloleaMido)acetic acid
Oleoyl N-methylaminoacetic acidMedialanic acid (VAN)DTXSID5042243EINECS 203-749-3Oleyl methylaminoethanoic acidUNII-4011K1S96YCRODASINIC OORAMIX O
物性
構造計算による物性
- XLogP
- 6.8
- 極性表面積
- 57.6 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 3
- 回転可能結合数
- 17
- 重原子数
- 25
- 形式電荷
- 0
- 複雑度
- 366
実験および物理化学的性質
Cosmetics
Cosmetic ingredients (Oleoyl Sarcosine) -> CIR (Cosmetic Ingredient Review)
Hair conditioning; Cleansing; Surfactant; Antistatic
Food Contact Substances
FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical DescriptionLiquid
Collision Cross Section200.7 Ų [M+H]+ [CCS Type: DT; Buffer gas: N2; Ionization: APCI+; Dataset: TOXCAST; Source Identifier: DTXSID5042243]
物理化学的性質
- 融点
- 16.1 · 16.1-17.0℃
- 沸点
- 499.4 · 499.4±38.0 °C(Predicted)
- 比重(密度)
- 0.961 · 0.961
- 闪点
- 221 °C · 221°C
- 貯蔵温度
- Store at room temperature
- 酸解離定数(Pka)
- 3.62 · 3.62±0.10(Predicted)
- 臭い (Odor)
- 100 · 100.00?%で。当たり障りのない
- 安定性
- 安定。可燃性。強力な酸化剤とは相容れない。
- 化粧品成分の機能
- 界面活性剤 - 洗浄帯電防止ヘアコンディショニングクレンジング
安全と法規制
GHS分類
GHS Classification
This chemical does not meet GHS hazard criteria for 0.7% (8 of 1088) of reports.
Danger
H315 (95%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P354+P338, P317, P321, P332+P317, P362+P364, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 1088 reports by companies from 25 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
危険有害性情報
Regulatory Information
Chemical: Glycine, N-methyl-N-(1-oxo-9-octadecenyl)-, (Z)-
Glycine, N-methyl-N-[(9Z)-1-oxo-9-octadecen-1-yl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Glycine, N-methyl-N-[(9Z)-1-oxo-9-octadecen-1-yl]- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
N-Methyl-N-oleoylglycine: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and Categories
Skin Irrit. 2 (95%)
Acute toxicity (Inhalation: Dusts and mists) - Category 4
毒性情報
Toxicity Summary
The CIR Expert Panel concluded that the following ingredients are safe as used in cosmetics when formulated to be non-irritating. The Expert Panel cautions that these ingredients should not be used in cosmetic products in which N-nitroso compounds can be found...Oleoyl Sarcosine...
Safe for use in cosmetics, with qualifications
安全データ
化学と産業
用途と製造
UsesCIR ingredient: Oleoyl Sarcosine
U.S. Production2023: 50,000 - <250,000 lb
Consumer UsesCorrosion inhibitor
Industry UsesLubricating agent
Household ProductsInformation on 1 consumer products that contain Oleoyl Sarcosine in the following categories is provided:
Use ClassificationCosmetics -> Hair conditioning; Cleansing; Surfactant; Antistatic
General Manufacturing Information
Petroleum Lubricating Oil and Grease Manufacturing
Glycine, N-methyl-N-[(9Z)-1-oxo-9-octadecen-1-yl]-: ACTIVE
応用分野
用途有機合成用。
用途界面活性剤、医薬部外品添加物(化粧品等)、防錆剤添加物
説明N-oleoylsarcosine is a molecule renowned for its excellent friction-reducing properties. It is used as a rust inhibitor and preservative, and it is believed that its amino acid groups form chelate structures with metal surfaces[1].
使用2-(N-Methyloleamido)acetic acid (cas# 110-25-8) is used as an anti-tarnishing sunscreen additive for lubricating oil and grease.
上流・下流製品情報
上流原料
関連反応
2 件
化合物ノート
読み込み中…