基本情報
- CAS
45267-19-4- 標準SMILES
CCCCCCCCCCCCCC(=O)NCCCN(C)C- InChIKey
IFYDWYVPVAMGRO-UHFFFAOYSA-N- 分子式
- C19H40N2O
- 平均分子量
- 312.5 g/mol
- 単同位体質量
- 312.3140639
概要
The CIR Expert Panel concluded that the 24 fatty acid amidopropyl dimethylamines ingredients listed below are safe in cosmetics when they are formulated to be non-sensitizing, which may be based on a QRA...Myristamidopropyl Dimethylamine...
名称と識別子
- 優先名称
- Myristamidopropyl Dimethylamine
- IUPAC
- N-[3-(dimethylamino)propyl]tetradecanamide
- 現地名
- N-[3-(ジメチルアミノ)プロピル]テトラデカンアミド
- 英語名
- N-[3-(dimethylamino)propyl]myristamide
- 分子式
- C19H40N2O
- 分子量
- 312.53
名称と別名
45267-19-4AldoxMyristamidopropyl dimethylamineN-[3-(Dimethylamino)propyl]myristamideSchercodine MTetradecanamide, N-[3-(dimethylamino)propyl]-Dimethylaminopropyl myristamideM-dimethylamineYXS2X34V8WN-(3-(Dimethylamino)propyl)myristamideTetradecanamide, N-(3-(dimethylamino)propyl)-DTXSID2068470
名称をさらに表示
N-(3-ジメチルアミノプロピル)テトラデカンアミドN-[3-(ジメチルアミノ)プロピル]テトラデカンアミドアルドックスAldox-d5Opti-free AldoxN,N-DimethylmyristamidopropylamineN-(3-(Dimethylamino)propyl)myristamid
SCHERCODINE M AMIDO-AMINERefChem:160405DTXCID4040395256-214-1N-(3-(Dimethylamino)propyl)tetradecanamideN-[3-(dimethylamino)propyl]tetradecanamideMFCD02029644Lexamine M 13
データベース識別子
- CAS
45267-19-4- PubChem CID
- 170759
物性
構造計算による物性
- XLogP
- 6.2
- 極性表面積
- 32.3 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
- 16
- 重原子数
- 22
- 形式電荷
- 0
- 複雑度
- 242
実験および物理化学的性質
Cosmetics
Cosmetic ingredients (Myristamidopropyl Dimethylamine) -> CIR (Cosmetic Ingredient Review)
Antistatic
Physical DescriptionCBI; Liquid
物理化学的性質
- 融点
- 49 · 49-51°C
- 沸点
- 208 · 208-215 °C(Press: 1-2 Torr)
- 比重(密度)
- 0.879 · 0.879
- 貯蔵温度
- Sealed in dry,Room Temperature
- 溶解性
- クロロホルム（微量）、メタノール（微量）
- 外見
- 個体
- 酸解離定数(Pka)
- 16.29 · 16.29±0.46(Predicted)
- 色
- ホワイトからオフホワイト
- 化粧品成分の機能
- 帯電防止
- InChI
- InChI=1S/C19H40N2O/c1-4-5-6-7-8-9-10-11-12-13-14-16-19(22)20-17-15-18-21(2)3/h4-18H2,1-3H3,(H,20,22)
- InChIKey
- IFYDWYVPVAMGRO-UHFFFAOYSA-N
- SMILES
- C(NCCCN(C)C)(=O)CCCCCCCCCCCCC
- LogP
- 5.58 · 5.580 (est)
- EPAの化学物質情報
- 3 · Tetradecanamide, N-[3-(dimethylamino)propyl]- (45267-19-4)
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
This chemical does not meet GHS hazard criteria for 0.8% (1 of 128) of reports.
Danger
H315 (98.4%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 128 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Warning
危険有害性情報
Regulatory Information
Chemical: Tetradecanamide, N-[3-(dimethylamino)propyl]-
Tetradecanamide, N-[3-(dimethylamino)propyl]- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Tetradecanamide, N-[3-(dimethylamino)propyl]- 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)
Other Safety InformationIMAP assessments - Fatty acid amido propyl dimethylamines: Human health tier II assessment
Hazard Classes and Categories
Skin Irrit. 2 (98.4%)
Skin corrosion - category 1
毒性情報
Toxicity Summary
The CIR Expert Panel concluded that the 24 fatty acid amidopropyl dimethylamines ingredients listed below are safe in cosmetics when they are formulated to be non-sensitizing, which may be based on a QRA...Myristamidopropyl Dimethylamine...
Safe for use in cosmetics, with qualifications
安全データ
化学と産業
薬理情報
MeSH Pharmacological ClassificationSubstances that prevent infectious agents or organisms from spreading or kill infectious agents in order to prevent the spread of infection.
用途と製造
UsesCIR ingredient: Myristamidopropyl Dimethylamine
U.S. Production2023: 5,500,000 - <7,000,000 lb
Industry UsesIntermediate
Use ClassificationCosmetics -> Antistatic
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Tetradecanamide, N-[3-(dimethylamino)propyl]-: ACTIVE
応用分野
使用Myristamidopropyl dimethylamine (MAPD), present as Aldox in Opti-Free Express Disinfecting Solution for contact lens care, was tested for its potential as a drug in treatment of Acanthamoeba keratitis. MAPD is an amidoamine compound that shows activity against Acanthamoeba as well as a variety of other causal agents of microbial keratitis.
上流・下流製品情報
上流原料
関連反応
5 件
化合物ノート
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