N-（2-ヒドロキシエチル）-N，N-ジメチル-3-（ステアロイルアミノ）プロパン-1-アミニウム＝ニトラート

(2-Hydroxyethyl)dimethyl(3-((1-oxooctadecyl)amino)propyl)ammonium nitrate

HCID 62463CAS 2764-13-8

部分構造検索類似構造を探す

基本情報

標準SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CCO.O=[N+]([O-])[O-]
InChIKey: HNWNELAGDBSCDG-UHFFFAOYSA-O
分子式: C25H53N2O2.NO3
平均分子量: 475.7 g/mol
単同位体質量: 475.3985218

名称と識別子

優先名称: (2-Hydroxyethyl)dimethyl(3-((1-oxooctadecyl)amino)propyl)ammonium nitrate
IUPAC: 2-hydroxyethyl-dimethyl-[3-(octadecanoylamino)propyl]azanium nitrate
現地名: N-（2-ヒドロキシエチル）-N，N-ジメチル-3-（ステアロイルアミノ）プロパン-1-アミニウム＝ニトラート
英語名: 2-hydroxyethyldimethyl-3-stearamidopropylammonium nitrate
分子式: C25H53N3O5
分子量: 475.72

名称と別名

2-Hydroxyethyl dimethyl 3-stearamidopropyl ammonium nitrateEINECS 220-432-5DTXSID0062632(2-Hydroxyethyl)dimethyl(3-((1-oxooctadecyl)amino)propyl)ammonium nitrate1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-((1-oxooctadecyl)amino)-, nitrate (1:1)(2-hydroxyethyl)dimethyl[3-[(1-oxooctadecyl)amino]propyl]ammonium nitrate1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (1:1)RefChem:68608DTXCID7037713220-432-52764-13-82-hydroxyethyl-dimethyl-[3-(octadecanoylamino)propyl]azanium;nitrate

名称をさらに表示

N-（2-ヒドロキシエチル）-N，N-ジメチル-3-（ステアロイルアミノ）プロパン-1-アミニウム＝ニトラートFELICIS-26022-hydroxyethyldimethyl-3-stearamidopropylammonium nitratestearamidopropyldimethyl-beta-hydroxyethylammonium nitrateTIANFU-CHEM 2-hydroxyethyldimethyl-3-stearamidopropylammonium nitrate(2-Hydroxyethyl)dimethyl[3-[(1-oxooctadecyl)amino]propyl]ammoniumnitrat1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-(1-oxooctadecyl)amino-, nitrate (salt)1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-o xooctadecyl)amino]-, nitrate (1:1)

SCHEMBL1188998HNWNELAGDBSCDG-UHFFFAOYSA-O1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-((1-oxooctadecyl)amino)-, nitrate (salt)NS00020181stearamidopropyldimethyl-2-hydroxyethyl ammonium nitrateN-(2-Hydroxyethyl)-N,N-dimethyl-3-octadecanamidopropan-1-aminium nitrate

データベース識別子

CAS: 2764-13-8
PubChem CID: 62463
DTXSID: DTXSID0062632
EC Number: 220-432-5

物性

構造計算による物性

極性表面積: 112 Å²
水素結合供与体数: 2
水素結合受容体数: 5
回転可能結合数: 22
重原子数: 33
形式電荷: 0
複雑度: 377

実験および物理化学的性質

Physical DescriptionLiquid

物理化学的性質

EPAの化学物質情報: 2 · 2-Hydroxyethyl dimethyl 3-stearamidopropyl ammonium nitrate (2764-13-8)

安全と法規制

GHS分類

GHS Classification · 4 件

Warning

H315 (99.3%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P273, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 144 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 3 件

Chemical: 1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (salt)

1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (1:1) 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)

(2-hydroxyethyl)dimethyl[3-[(1-oxooctadecyl)amino]propyl]ammonium nitrate: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (99.3%)

安全データ

tsca: TSCA listed

化学と産業

用途と製造

U.S. Production2023: <50,000 lb

Industry UsesAnti-static agent

General Manufacturing Information · 2 件

Plastics Material and Resin Manufacturing

1-Propanaminium, N-(2-hydroxyethyl)-N,N-dimethyl-3-[(1-oxooctadecyl)amino]-, nitrate (1:1): ACTIVE

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