基本情報
- CAS
67633-63-0- 標準SMILES
CCOS(=O)(=O)[O-].CC[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCC(C)C- InChIKey
IMWSVOVXSVRHAO-UHFFFAOYSA-N- 分子式
- C25H53N2O.C2H5O4S
- 平均分子量
- 522.8 g/mol
- 単同位体質量
- 522.40664413
名称と識別子
- 優先名称
- Isostearamidopropyl ethyldimonium ethosulfate
- IUPAC
- ethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium;ethyl sulfate
- 現地名
- イソステアラミドプロピルエチルジモニウムエトサルフェート
- 英語名
- ethyldimethyl[3-[(1-oxoisooctadecyl)amino]propyl]ammonium ethyl sulphate
- 分子式
- C27H58N2O5S
- 分子量
- 522.82482
名称と別名
67633-63-0Isostearamidopropyl ethyldimonium ethosulfate1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxoisooctadecyl)amino]-, ethyl sulfateU059JNZ17LFOAMQUAT IAESEINECS 266-778-0MACKERNIUM CC112P9CORUM 5118Ethyldimethyl[3-[(1-oxoisooctadecyl)amino]propyl]ammonium ethyl sulphateN-Ethyl-N,N-dimethyl-3-((1-oxoisooctadecyl)amino)-1-propanaminium ethyl sulfateEthyldimethyl(3-((1-oxoisooctadecyl)amino)propyl)ammonium ethyl sulphateN-(3-Isostearylamido)propyl-N,N-dimethyl-N-ethylammonium ethyl sulfate
名称をさらに表示
イソステアラミドプロピルエチルジモニウムエトサルフェート1,2,3-Propanetricarboxylicacid, 2-hydroxy-, neodymium(3+) salt (1:1)N,N-Dimethyl-N-ethyl-3-[(1-oxoisooctadecyl)-amino]-1-propanaminium ethosulfethyl-dimethyl-[3-(16-methylheptadecanoylamino)propyl]azanium,ethyl sulfaten-ethyl-n,n-dimethyl-3-[(1-oxoisooctadecyl)amino]-1-propanaminiu ethyl sulfateN-Ethyl-N,N-dimethyl-3-[(1-oxoisooctadecyl)amino]-1-propanaminium ethyl sulfate
物性
構造計算による物性
- 極性表面積
- 104 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 5
- 回転可能結合数
- 21
- 重原子数
- 35
- 形式電荷
- 0
- 複雑度
- 456
実験および物理化学的性質
CosmeticsHair conditioning; Antistatic
Physical DescriptionLiquid
物理化学的性質
- 化粧品成分の機能
- 帯電防止ヘアコンディショニング
- LogP
- 3.616 · 3.616 (est)
- EPAの化学物質情報
- 1 · 1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxoisooctadecyl)amino]-, ethyl sulfate (67633-63-0)
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 0.7% (1 of 141) of reports.
Danger
H302 (98.6%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 141 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Regulatory Information
Chemical: 1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxoisooctadecyl)amino]-, ethyl sulfate
1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxoisooctadecyl)amino]-, ethyl sulfate (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxoisooctadecyl)amino]-, ethyl sulfate (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)
1-Propanaminium, N-ethyl-N,N-dimethyl-3-(1-oxoisooctadecyl)amino-, ethyl sulfate: 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 CategoriesAcute Tox. 4 (98.6%)
安全データ
- tsca
- TSCA listed
- 化審法
- 優先評価化学物質
化学と産業
用途と製造
U.S. Production2023: <50,000 lb
Consumer UsesSurfactant (surface active agent)
Industry UsesSurfactant (surface active agent)
Household ProductsInformation on 10 consumer products that contain Isostearamidopropyl ethyldimonium ethosulfate in the following categories is provided:
Use ClassificationCosmetics -> Hair conditioning; Antistatic
General Manufacturing Information
Soap, Cleaning Compound, and Toilet Preparation Manufacturing
1-Propanaminium, N-ethyl-N,N-dimethyl-3-[(1-oxoisooctadecyl)amino]-, ethyl sulfate (1:1): ACTIVE
サプライヤー4 社
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
厦门欣达诺生物科技有限公司0592-6266840 15750707980 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
補足説明
定義本品は、次の化学式で表される4級アンモニウム塩である。
関連反応
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