도데킬트리메틸암모늄 브롬화물

Dodecyltrimethylammonium bromide

HCID 14249

기본 정보

CAS
1119-94-4
표준 SMILES
CCCCCCCCCCCC[N+](C)(C)C.[Br-]
InChIKey
XJWSAJYUBXQQDR-UHFFFAOYSA-M
분자식
C15H34N.Br
평균 분자량
308.34 g/mol

개요

Dodecyltrimethylammonium bromide is a bromide salt and a quaternary ammonium salt. It has a role as a surfactant. It contains a dodecyltrimethylammonium ion.

이름 및 식별자

우선 이름
Dodecyltrimethylammonium bromide
IUPAC
dodecyl(trimethyl)azanium bromide
현지명
도데킬트리메틸암모늄 브롬화물
영어명
Dodecyltrimethylammonium Bromide
분자식
C15H34BrN
분자량
308.34

이름 및 동의어

Dodecyltrimethylammonium bromide1119-94-4DctabDTABLaurtrimonium bromideLTABLauryltrimethylammonium bromideMorpan DDTAB (surfactant)1-Dodecanaminium, N,N,N-trimethyl-, bromideTrimethyllaurylammonium bromideTrimethyldodecylammonium bromide
이름 더 보기
도데킬트리메틸암모늄브롬화물도데킬트리메틸암모늄브롬화물라우트라이모늄브로마이드1231N,N,N-TRIMETHYL-1-DODECANAMINIUM BROMIDE1232CetrimideSubstituteDodecayltrimethylaminiumbromide123B
FSM 23N-Lauryl-N,N,N-trimethylammonium bromideN,N,N-Trimethyldodecan-1-ammonium bromideDTXSID5044366N,N,N-Trimethyl-1-dodecanaminiuim bromideLauryltrimethylaminium bromide6IC8NZ97S2DTXCID3024366

데이터베이스 식별자

CAS
1119-94-4
PubChem CID
14249
DTXSID
DTXSID5044366
ChEMBL
CHEMBL109873
ChEBI
CHEBI:282662
UNII
6IC8NZ97S2
EC Number
214-290-3

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

실험 및 물리화학적 성질

Chemical ClassesNitrogen Compounds -> Quaternary Amines
Cosmetics · 2건

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

Hair conditioning; Antistatic; Preservative

Physical Description · 2건

Dry Powder

White to light yellow odorless powder; Hygroscopic; [Acros Organics MSDS]

물리화학적 성질

녹는점
246 °C · 246 °C (dec.)(lit.)
밀도
1.1566 · 1.1566 (rough estimate)
증기압
0 Pa · 0Pa at 20℃
굴절률
1.526 · 1.5260 (estimate)
인화점
246 °C · 246°C
저장 조건
30 °C · Store below +30°C.

화학적 성질

white to slightly yellow powder

안전 및 규제

GHS 분류

GHS Classification · 6건

This chemical does not meet GHS hazard criteria for 2.2% (2 of 89) of reports.

Danger

H301 (20.2%): Toxic if swallowed [Danger Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 89 reports by companies from 18 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

유해성 정보

Regulatory Information · 4건

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

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

REACH registered substance: Dodecyltrimethylammonium bromide (EC: 214-290-3)

1-Dodecanaminium, N,N,N-trimethyl-, bromide: 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 - Mono- and di-alkyl quaternary ammonium surfactants: Environment tier II assessment
Hazards Summary · 1건

Causes somnolence and dermatitis in dermal lethal-dose studies of rabbits; Causes other changes in lungs, thorax, or respiration in intravenous lethal-dose studies of mice and rats; [RTECS] Oral LD50 (rat) = 200-1,000 mg/kg; An irritant that may cause serious eye injury; Harmful by ingestion, inhalation, and skin absorption; [Acros Organics MSDS]

Hazard Classes and Categories · 3건

Acute Tox. 3 (20.2%)

Acute toxicity - category 4

Acute toxicity (Oral) - Category 3

독성 정보

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 Bromide...

Safe for use in cosmetics, with qualifications

안전 데이터

wgk
3
tsca
TSCA listed
rtecs
BQ3195000
ridadr
UN3077
독성
LD50 orally in Rabbit: 200 - 1000 mg/kg
HS 번호
29239000

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

UsesCIR ingredient: Laurtrimonium Bromide
U.S. Production2023: <50,000 lb
Industry UsesDefoamer
Use ClassificationCosmetics -> Hair conditioning; Antistatic; Preservative
General Manufacturing Information · 2건

Paint and Coating Manufacturing

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

응용 분야

용도Dodecyltrimethylammonium Bromide is a quaternary ammonium salt useful as paint strippers, foaming stabilizers, and bactericidal lotions.

일반 설명Dodecyltrimethylammonium bromide is a quaternary ammonium surfactant.

공급사100 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]

추가 설명

정의ChEBI: A quarternary ammonium cation having one dodecyl and three methyl substituents around the central nitrogen.

관련 반응

2건

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