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염화 도데실트리메틸암모늄

Dodecyltrimethylammonium chloride

HCID 8152
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기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
112-00-5
표준 SMILES
CCCCCCCCCCCC[N+](C)(C)C.[Cl-]
InChIKey
DDXLVDQZPFLQMZ-UHFFFAOYSA-M
분자식
C15H34N.Cl
평균 분자량
263.89 g/mol

개요

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...Laurtrimonium Chloride...

이름 및 식별자

우선 이름
Dodecyltrimethylammonium chloride
IUPAC
dodecyl(trimethyl)azanium chloride
현지명
염화 도데실트리메틸암모늄
영어명
Dodecyltrimethylammonium chloride
분자식
C15H34ClN
분자량
263.89

이름 및 동의어

Dodecyltrimethylammonium chloride112-00-5DODECYL TRIMETHYL AMMONIUM CHLORIDEDTACAlicopLauryltrimethylammonium chlorideLaurtrimonium chlorideCation BBAliquat 4Dehyquart LTCation FBNissan Cation BB
이름 더 보기
염화도데실트라이메틸암모늄염화도데실트리메틸암모늄염화도데실트라이메틸암모늄라우트라이모늄클로라이드LTACTRIMETHYLDODECYLAMMONIUM CHLORIDEN,N,N-Trimethyl-1-dodecanaminium chloride123Caliguat4arguad12
n-Dodecyltrimethylammonium chlorideArquad 12Arquad 12DTrimethyllaurylammonium chlorideCatiogen LNissan Cation FBQuartamin 24PQuartamin 24W

데이터베이스 식별자

CAS
112-00-5
PubChem CID
8152
DTXSID
DTXSID1026900
ChEMBL
CHEMBL1884887
UNII
A81MSI0FIC
EC Number
203-927-0

물성

구조 계산 물성보충 중

극성 표면적
0 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
1
회전 가능 결합 수
11
무거운 원자 수
17
형식 전하
0
복잡도
135

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Quaternary Amines
Cosmetics · 2건

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

Antistatic; Preservative; Emulsifying

Vapor Pressure0.00000001 [mmHg]
Physical Description · 2건

CBI; Liquid

Solid; [EPA ChAMP: Initial Risk-Based Prioritization Document] White to light yellow powder and chunks; Hygroscopic; [Acros Organics MSDS]

물리화학적 성질

녹는점
37 °C · 37 °C
끓는 점
412.12 °C · 412.12°C (rough estimate)
밀도
0.9265 · 0.9265 (rough estimate)
증기압
0 Pa · 0Pa at 25℃
굴절률
20 · n20/D 1.426
인화점
19 °C · 19 °C
저장 조건
Keep in dark place,Sealed in dry,Room Temperature
용해도
2 O: · H2O: 50 mg/mL, 투명, 무색
물리적 상태
분말 또는 덩어리
색상
흰색에서 밝은 노란색

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 2.5% (12 of 476) of reports.

Danger

H302 (87.2%): Harmful if swallowed [Warning Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 476 reports by companies from 28 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Warning

유해성 정보

Regulatory Information · 4건

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

1-Dodecanaminium, N,N,N-trimethyl-, chloride (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Dodecanaminium, 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: 14-09-2021 https://echa.europa.eu/registration-dossier/-/registered-dossier/24215

1-Dodecanaminium, N,N,N-trimethyl-, chloride: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Cationic surfactants: Human health tier II assessment
Hazards SummaryIncreased liver weights (with corresponding histopathology) and increased ALT activity in repeated-dose oral studies of animals; [EPA ChAMP: Hazard Characterizations] An irritant; Harmful by ingestion; [Acros Organics MSDS]
Hazard Classes and Categories · 4건

Acute Tox. 4 (87.2%)

Acute toxicity - category 4

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

Purifying or cleansing agents, usually salts of long-chain aliphatic bases or acids, that exert cleansing (oil-dissolving) and antimicrobial effects through a surface action that depends on possessing both hydrophilic and hydrophobic properties.

Agents that modify interfacial tension of water; usually substances that have one lipophilic and one hydrophilic group in the molecule; includes soaps, detergents, emulsifiers, dispersing and wetting agents, and several groups of antiseptics.

용도 및 제조

Uses · 3건

CIR ingredient: Laurtrimonium Chloride

Typical uses of category members include surfactants, intermediates, anti-scaling agents, fabric softeners, multifunctional laundry detergents, antistatic sprays, germicides, deodorizers, emulsifiers, hair-care products, industrial lubricants, and corrosion inhibitors; [EPA ChAMP: Initial Risk-Based Prioritization Document]

Using Disinfectants or Biocides [Category: Clean]

U.S. Production2023: 400,000 - <550,000 lb
Consumer UsesCorrosion inhibitor
Industry UsesCBI
Household ProductsInformation on 5 consumer products that contain Laurtrimonium Chloride in the following categories is provided:
Use ClassificationCosmetics -> Antistatic; Preservative; Emulsifying
General Manufacturing Information · 2건

Plastics Material and Resin Manufacturing

1-Dodecanaminium, N,N,N-trimethyl-, chloride (1:1): ACTIVE

응용 분야

관련 반응

9건
반응 기록 만들기
HRID 5288 반응식
HRID 5288촉매로uspto-grants-1993_09
HRID 1089585 반응식
HRID 1089585촉매로uspto-grants-1990_10
HRID 1576943 반응식
HRID 1576943촉매로uspto-grants-1976_09
HRID 1589289 반응식
HRID 1589289촉매로uspto-grants-1986_02
HRID 1589290 반응식
HRID 1589290촉매로uspto-grants-1986_02
HRID 1700049 반응식
HRID 1700049촉매로uspto-grants-2002_02
HRID 1981680 반응식
HRID 1981680촉매로uspto-grants-1986_06
HRID 1981684 반응식
HRID 1981684촉매로uspto-grants-1986_06
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화합물 노트

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이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
더보기
새 노트새 반응견적 요청하기
수소이온지수(pH)
4 to · 4.0 to 7.5(50 g/L, 25 ℃)
수용성
녹는
BRN
3915951 · 3915951
안정성
안정적인. 강한 산화제와 호환되지 않습니다. 습기로부터 보호하십시오.
화장품 원료 기능
항균 방부제계면활성제 - 유화제대전방지제
InChI
1S/C15H34N.ClH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;/h5-15H2,1-4H3;1H/q+1;/p-1
InChIKey
DDXLVDQZPFLQMZ-UHFFFAOYSA-M
SMILES
[Cl-].CCCCCCCCCCCC[N+](C)(C)C
LogP
1.22 at · 1.22 at 25℃
표면장력
860 · 860-1710mN/m at 52.78-105.56g/L and 25℃
EPA
Dodecyl trimethyl ammonium chloride (112-00-5)

화학적 성질

white solid

Acute toxicity (Oral) - Category 4

Hazardous to the aquatic environment (Acute) - Category 1

독성 정보

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.
Toxicity Summary · 2건

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...Laurtrimonium Chloride...

Safe for use in cosmetics, with qualifications

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
JR2122500
ridadr
UN 3077 9/PG 3
독성
LD50 orally in Rabbit: 200 - 1000 mg/kg
HS 번호
29239000
risk_code
36/37/38-50-50/53-22-67-11
hazard_code
Xi,N,Xn,F
safety_code
26-61-60-37/39-36-16
포장분류
III
위험 등급
6.1(b)
기존화학 물질
KE-34505
F 고인화성물질
3-10
Hazard Classifications
Acute Tox. 4 OralAquatic Acute 1Eye Irrit. 2Skin Irrit. 2
스토리지 클래스
13 - Non Combustible Solids

용도Dodecyltrimethylammonium chloride belongs to quaternary ammonium salts,it is useful as paint strippers, foaming stabilizers, and bactericidal lotions.

일반 설명Dodecyltrimethylammonium chloride is a cationic alkyltrimethylammonium chloride surfactant that can undergo micellization in aqueous solution. it is mainly used for the denaturation of proteins.

상·하류 제품 정보

상류 원료

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