ドデシルトリメチルアンモニウム ブロミド

Dodecyltrimethylammonium bromide

HCID 14249

基本情報

CAS
1119-94-4
標準SMILES
CCCCCCCCCCCC[N+](C)(C)C.[Br-]
InChIKey
XJWSAJYUBXQQDR-UHFFFAOYSA-M
分子式
C15H34N.Br
平均分子量
308.34 g/mol

概要

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

名称と識別子

優先名称
Dodecyltrimethylammonium bromide
IUPAC
dodecyl(trimethyl)azanium bromide
現地名
ドデシルトリメチルアンモニウム ブロミド
英語名
Dodecyltrimethylammonium Bromide
分子式
C15H34BrN
分子量
308.34

名称と別名

Dodecyltrimethylammonium bromide1119-94-4DctabDTABLaurtrimonium bromideLTABLauryltrimethylammonium bromideMorpan DDTAB (surfactant)1-Dodecanaminium, N,N,N-trimethyl-, bromideTrimethyllaurylammonium bromideTrimethyldodecylammonium bromide
名称をさらに表示
ドデシルトリメチルアンモニウム ブロミドN-ドデシル-N,N,N-トリメチルアミニウム·ブロミドドデシルトリメチルアンモニウムブロミドN,N,N-トリメチルドデカン-1-アミニウム·ブロミドトリメチル(ドデシル)アミニウム·ブロミドトリメチルドデシルアミニウム·ブロミドN,N,N-トリメチル-1-ドデカンアミニウム·ブロミドN,N,N-トリメチルドデシルアミニウム·ブロミドドデシルトリメチルアミニウム·ブロミドドデシルトリメチルアンモニウム·ブロミドラウリルトリメチルアミニウム·ブロミド臭化ドデシルトリメチルアンモニウムn-ドデシルトリメチルアンモニウム ブロミド臭化ドデシルトリメチルアンモニウム ブロマイド 臭化物臭化ラウリルトリメチルアンモニウムラウルトリモニウムブロミドラウリルトリメチルアンモニウムブロミドN,N,N-トリメチルドデカン-1-アミニウムブロミドドデシルトリメチルアンモニウム=ブロミド臭化ドデシルトリメチルアンモニウム, 97%1231N,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

データベース識別子

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

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
11
重原子数
17

実験および物理化学的性質

Chemical ClassesNitrogen Compounds -> Quaternary Amines
Cosmetics · 2 件

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

Hair conditioning; Antistatic; Preservative

Physical Description · 2 件

Dry Powder

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

物理化学的性質

融点
246 °C · 246 °C (dec.)(lit.)
比重(密度)
1.1566 · 1.1566 (rough estimate)
蒸気圧
0 Pa · 0Pa at 20℃
屈折率
1.526 · 1.5260 (estimate)
闪点
246 °C · 246°C
貯蔵温度
30 °C · Store below +30°C.

化学的性質

化学的特性white to slightly yellow powder

安全と法規制

GHS分類

GHS Classification · 6 件

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

危険有害性情報

Regulatory Information · 4 件

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 · 1 件

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 · 3 件

Acute Tox. 3 (20.2%)

Acute toxicity - category 4

Acute toxicity (Oral) - Category 3

毒性情報

Toxicity Summary · 2 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...Laurtrimonium Bromide...

Safe for use in cosmetics, with qualifications

安全データ

F
3-10
wgk
3
tsca
TSCA listed
rtecs
BQ3195000
ridadr
UN3077
毒性
LD50 orally in Rabbit: 200 - 1000 mg/kg

化学と産業

薬理情報

MeSH Pharmacological Classification · 2 件

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.

用途と製造

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

Paint and Coating Manufacturing

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

応用分野

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

一般的な説明Dodecyltrimethylammonium bromide is a quaternary ammonium surfactant.

調製方法

純化方法Purify the salt by repeated crystallisation from acetone. Wash it with diethyl ether and dry it in a vacuum oven at 60o [Dearden & Wooley J Phys Chem 91 2404 1987]. [Beilstein 4 IV 798.]

サプライヤー100 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。

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

関連反応

2 件

化合物ノート

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