CAS 68921-83-5 Quaternium-70 (HCID 111772)

基本情報

CAS: 68921-83-5
標準SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CC(=O)OCCCCCCCCCCCCCC.[Cl-]
InChIKey: DKJLEUVQMKPSHB-UHFFFAOYSA-N
分子式: C39H79N2O3.Cl
平均分子量: 659.5 g/mol
単同位体質量: 658.5779221

名称と識別子

優先名称: Quaternium-70
IUPAC: dimethyl-[3-(octadecanoylamino)propyl]-(2-oxo-2-tetradecoxyethyl)azanium chloride

名称と別名

Quaternium-70ACI17BG2RWEINECS 272-964-2Stearamidopropyl dimethyl (myristyl acetate) ammonium chloride(3-Stearamidopropyl)dimethylmyristoyloxycarbonylmethylammonium chloride1-Propanaminium, N,N-dimethyl-3-[(1-oxooctadecyl)amino]-N-[2-oxo-2-(tetradecyloxy)ethyl]-, chlorideDimethyl(3-((1-oxooctadecyl)amino)propyl)(2-oxo-2-(tetradecyloxy)ethyl)ammonium chlorideDimethyl[3-[(1-oxooctadecyl)amino]propyl][2-oxo-2-(tetradecyloxy)ethyl]ammonium chloride1-Propanaminium, N,N-dimethyl-3-((1-oxooctadecyl)amino)-N-(2-oxo-2-(tetradecyloxy)ethyl)-, chloride1-Propanaminium, N,N-dimethyl-3-((1-oxooctadecyl)amino)-N-(2-oxo-2-(tetradecyloxy)ethyl)-, chloride (1:1)N,N-DIMETHYL-3-((1-OXOOCTADECYL)AMINO)-N-(2-OXO-2-TETRADECENYLOXY)ETHYL)-1-PROPANAMINIUM CHLORIDE1-Propanaminium, N,N-dimethyl-3-[(1-oxooctadecyl)amino]-N-[2-oxo-2-(tetradecyloxy)ethyl]-, chloride (1:1)

名称をさらに表示

RefChem:871341QUATERNIUM-70 [INCI]1-Propanaminium, N,N-dimethyl-3-((1-oxooctadecyl)amino)-N-(2-oxo-2-(tetradecenylox-y)ethyl)-, chloride1-Propanaminium, N,N-dimethyl-3-(1-oxooctadecyl)amino-N-2-oxo-2-(tetradecyloxy)ethyl-, chlorideN,N-Dimethyl-3-((1-oxooctadecyl)amino)-N-(2-oxo-2-(tetradecenylox-y)ethyl)-1-propanaminium chloride68921-83-5dimethyl-[3-(octadecanoylamino)propyl]-(2-oxo-2-tetradecoxyethyl)azanium;chlorideUNII-ACI17BG2RW

データベース識別子

CAS: 68921-83-5
PubChem CID: 111772
DTXSID: DTXSID20887572
UNII: ACI17BG2RW
EC Number: 272-964-2

物性

構造計算による物性

極性表面積: 55.4 Å²
水素結合供与体数: 1
水素結合受容体数: 4
回転可能結合数: 36
重原子数: 45
形式電荷: 0
複雑度: 622

実験および物理化学的性質

CosmeticsAntistatic; Hair conditioning

安全と法規制

GHS分類

GHS Classification · 4 件

Danger

H317 (75%): May cause an allergic skin reaction [Warning Sensitization, Skin]

P261, P264+P265, P272, P273, P280, P302+P352, P305+P354+P338, P317, P321, P333+P317, P362+P364, P391, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 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 Information · 3 件

Chemical: 1-Propanaminium, N,N-dimethyl-3-[(1-oxooctadecyl)amino]-N-[2-oxo-2-(tetradecyloxy)ethyl]-, chloride

REACH registered substance: Dimethyl[3-[(1-oxooctadecyl)amino]propyl][2-oxo-2-(tetradecyloxy)ethyl]ammonium chloride (EC: 272-964-2)

1-Propanaminium, N,N-dimethyl-3-(1-oxooctadecyl)amino-N-2-oxo-2-(tetradecyloxy)ethyl-, chloride: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.

Hazard Classes and CategoriesSkin Sens. 1 (75%)

化学と産業

用途と製造

Household ProductsInformation on 3 consumer products that contain Quaternium-70 in the following categories is provided:

Use ClassificationCosmetics -> Antistatic; Hair conditioning

General Manufacturing Information1-Propanaminium, N,N-dimethyl-3-[(1-oxooctadecyl)amino]-N-[2-oxo-2-(tetradecyloxy)ethyl]-, chloride (1:1): ACTIVE

化合物ノート

読み込み中…