기본 정보
- 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
이름 더 보기
데이터베이스 식별자
- CAS
112-00-5- PubChem CID
- 8152
- DTXSID
DTXSID1026900- ChEMBL
CHEMBL1884887- UNII
- A81MSI0FIC
- EC Number
- 203-927-0
물성
구조 계산 물성
- 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
Cosmetics
Cosmetic ingredients (Laurtrimonium Chloride) -> CIR (Cosmetic Ingredient Review)
Antistatic; Preservative; Emulsifying
Physical Description
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
- 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
안전 및 규제
GHS 분류
GHS Classification
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
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
Hazard Classes and Categories
Acute Tox. 4 (87.2%)
Acute toxicity - category 4
Acute toxicity (Oral) - Category 4
Hazardous to the aquatic environment (Acute) - Category 1
독성 정보
Toxicity Summary
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
화학 및 산업
약리 정보
MeSH Pharmacological Classification
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
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]
General Manufacturing Information
Plastics Material and Resin Manufacturing
1-Dodecanaminium, N,N,N-trimethyl-, chloride (1:1): ACTIVE
응용 분야
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
공급사50 곳
관련 반응
연결된 노트
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