스테아트라이모늄클로라이드

Stearyltrimethylammonium chloride

HCID 8155CAS 112-03-8

기본 정보

표준 SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)C.[Cl-]
InChIKey
VBIIFPGSPJYLRR-UHFFFAOYSA-M
분자식
C21H46N.Cl
평균 분자량
348 g/mol

개요

Stearyltrimethylammonium chloride is an organic molecular entity.

이름 및 식별자

우선 이름
Stearyltrimethylammonium chloride
IUPAC
trimethyl(octadecyl)azanium chloride
현지명
스테아트라이모늄클로라이드
영어명
Trimethylstearylammonium Chloride
분자식
C21H46ClN
분자량
348.06

이름 및 동의어

112-03-8Trimethylstearylammonium chlorideStacCation ABAliquat 7Stearyltrimethylammonium chlorideNissan cation ABQuaternium-10Arquad 18Stearyl trimethyl ammonium chlorideArquad 18-50Monostearyl trimethyl ammonium chloride
이름 더 보기
스테아트라이모늄클로라이드1831Steartrimonium 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

데이터베이스 식별자

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

물성

구조 계산 물성

극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
17
무거운 원자 수
23

실험 및 물리화학적 성질

Cosmetics · 2건

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

Preservative; Hair conditioning

Physical DescriptionCBI; Large Crystals

물리화학적 성질

끓는 점
249 ℃[at · 249℃[at 101 325 Pa]
밀도
0.91 · 0.91[at 20℃]
증기압
0 Pa · 0Pa at 25℃
저장 조건
Inert atmosphere,Room Temperature
물리적 상태
powder to crystal
색상
하얀색

화학적 성질

solid

안전 및 규제

GHS 분류

GHS Classification · 6건

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

유해성 정보

Regulatory Information · 4건

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 · 3건

Acute Tox. 4 (88.1%)

Acute toxicity - category 4

Acute toxicity (Oral) - Category 4

독성 정보

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

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)

안전 데이터

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

화학 및 산업

약리 정보

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)

용도 및 제조

Uses · 2건

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

응용 분야

용도Emulsion (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.

공급사50 곳

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]

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12건

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