トリメチルステアリルアンモニウム クロリド

Stearyltrimethylammonium chloride

HCID 8155CAS 112-03-8
部分構造検索類似構造を探す

基本情報

標準SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
InChIKey
VBIIFPGSPJYLRR-UHFFFAOYSA-M
分子式
C21H46N.Cl
平均分子量
348 g/mol

概要

Stearyltrimethylammonium chloride is an organic molecular entity.

名称と識別子

優先名称
Stearyltrimethylammonium chloride
IUPAC
trimethyl(octadecyl)azanium chloride
現地名
トリメチルステアリルアンモニウム クロリド
英語名
Trimethylstearylammonium Chloride
分子式
C21H46ClN
分子量
348.06

名称と別名

112-03-8Trimethylstearylammonium chlorideStacCation ABAliquat 7Stearyltrimethylammonium chlorideNissan cation ABQuaternium-10Arquad 18Stearyl trimethyl ammonium chlorideArquad 18-50Monostearyl trimethyl ammonium chloride
名称をさらに表示
トリメチルステアリルアンモニウム クロリドN,N,N-トリメチル-1-オクタデカンアミニウムトリメチル(オクタデシル)アミニウムトリメチルオクタデシルアミニウム·クロリドトリメチルオクタデシルアンモニウムオクタデシルトリメチルアミニウムアルクアッド18ステアリルトリメチルアンモニウムクロリドステアリルトリメチルアミニウムアリクアット7ステアリルトリメチルアミニウム·クロリドトリメチルステアリルアンモニウムトリメチルステアリルアンモニムクロリドオクタデシルトリメチルアンモニウムアリクワット7オクタデシルトリメチルアミニウム·クロリドN,N,N-トリメチルオクタデカン-1-アミニウム·クロリドトリメチルステアリルアミニウム·クロリドオクタデシルトリメチルアンモニウム·クロリドN,N,N-トリメチル-1-オクタデカンアミニウム·クロリド1831Steartrimonium chlorideOTACOctadecy trimethyl ammonium chlorideTC-8
N,N,N-Trimethyl-1-octadecanaminium chlorideCZ70647U92trimethyl(octadecyl)azanium chlorideRefChem:871332N,N,N-trimethyloctadecan-1-aminium chlorideTrimethyloctadecylammonium chlorideOCTADECYLTRIMETHYLAMMONIUM CHLORIDE1-Octadecanaminium, N,N,N-trimethyl-, chloride

データベース識別子

CAS
112-03-8
PubChem CID
8155
DTXSID
DTXSID1026902
ChEMBL
CHEMBL118745
ChEBI
CHEBI:81710
UNII
CZ70647U92
EC Number
203-929-1

物性

構造計算による物性

極性表面積
0 Ų
水素結合供与体数
0
水素結合受容体数
1
回転可能結合数
17
重原子数
23

実験および物理化学的性質

Cosmetics · 2 件

Cosmetic ingredients (Steartrimonium Chloride) -> CIR (Cosmetic Ingredient Review)

Preservative; Hair conditioning

Physical DescriptionCBI; Large Crystals

物理化学的性質

沸点
249 ℃[at · 249℃[at 101 325 Pa]
比重(密度)
0.91 · 0.91[at 20℃]
蒸気圧
0 Pa · 0Pa at 25℃
貯蔵温度
Inert atmosphere,Room Temperature
外見
powder to crystal
色
White

化学的性質

化学的特性solid

安全と法規制

GHS分類

GHS Classification · 6 件

This chemical does not meet GHS hazard criteria for 3.7% (10 of 268) of reports.

Danger

H302 (88.1%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P262, P264, P264+P265, P270, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P354+P338, P316, P317, P321, P330, P361+P364, P362+P364, P363, P391, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 268 reports by companies from 19 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 · 4 件

Chemical: 1-Octadecanaminium, N,N,N-trimethyl-, chloride

1-Octadecanaminium, N,N,N-trimethyl-, chloride (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Octadecanaminium, N,N,N-trimethyl-, chloride (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)

Status: Active Update: 21-12-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/10127

Octadecyltrimethylammonium 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.

Other Safety InformationIMAP assessments - Cationic surfactants: Human health tier II assessment
Hazard Classes and Categories · 3 件

Acute Tox. 4 (88.1%)

Acute toxicity - category 4

Acute toxicity (Oral) - Category 4

毒性情報

Health EffectsQuaternium-10 may react to produce nitrosamines, which are believed to be carcinogenic. (L1890)
Exposure RoutesOral (A2880) ; inhalation (A2880) ; dermal (L1889)
Toxicity Summary · 3 件

The CIR Expert Panel concluded the following ingredients are safe in the present practices of use and concentration described in the safety assessment when formulated to be non-irritating...Steartrimonium Chloride...

Safe for use in cosmetics, with qualifications

While quaternium-10 itself is not toxic, it is a nitrosating agent. Nitrosating agents may decompose and/or react to cause nitrosamine contamination. Nitrosamines are produced from secondary amines and amides in the presence of nitrite ions and are believed to be carcinogenic. Once in the body, nitrosamines are activated by cytochrome P-450 enzymes. They are then believed to induce their carcinogenic effects by forming DNA adducts at the N- and O-atoms. (L1889, L1890, A2878, A2879, A2880)

Carcinogen ClassificationNot listed by IARC. Certain nitrosamines are classified by IARC as either probably or possibly carcinogenic to humans (Groups 2A and 2B, respectively). (L135)

安全データ

wgk
3
tsca
TSCA listed
rtecs
BT1750000
ridadr
UN1759
hs_code
29239000
risk_code
20/21/22-36/37/38-21/22

化学と産業

薬理情報

Metabolism/MetabolitesNitrosamines can enter the body via ingestion, inhalation, or dermal contact. Once in the body, nitrosamines are metabolized by cytochrome P-450 enzymes, which essentially activates them into carcinogens. (A2878, A2879)

用途と製造

Uses · 2 件

CIR ingredient: Steartrimonium Chloride

Quaternium-10 is a quaternary ammonium salt found in numerous cosmetics. (L1890)

U.S. Production2023: <75,000 lb
Household ProductsInformation on 43 consumer products that contain Steartrimonium chloride in the following categories is provided:
Use ClassificationCosmetics -> Preservative; Hair conditioning
General Manufacturing Information1-Octadecanaminium, N,N,N-trimethyl-, chloride (1:1): ACTIVE

応用分野

用途コンデショニング剤原料,帯電防止剤 (NITE CHRIP)

使用Emulsion (main components are high polymeric and cyclic silicones); forms a protective film to coat split ends; conditioning agent for rinses and shampoos; glazing agent for hair.

上流・下流製品情報

サプライヤー50 社

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
衢州润东化工有限公司0570-8789886 18892685668 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [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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