도데킬트리메틸암모늄 브롬화물

도데킬트리메틸암모늄브롬화물 · 라우트라이모늄브로마이드 · DTAB · 1231 · N,N,N-TRIMETHYL-1-DODECANAMINIUM BROMIDE · LAURTRIMONIUM BROMIDE · 1232 · CetrimideSubstitute

https://huagongshe.com/ko/chemical/14249

식별자 및 물리적 특성

CAS No.	1119-94-4
분자식	C15H34N.Br
평균 분자량	308.34 g/mol
SMILES	CCCCCCCCCCCC[N+](C)(C)C.[Br-]
InChIKey	XJWSAJYUBXQQDR-UHFFFAOYSA-M
PubChem CID	14249
ChEMBL	CHEMBL109873
ChEBI	CHEBI:282662
EC No.	214-290-3
DTXSID	DTXSID5044366
현지명	도데킬트리메틸암모늄 브롬화물

화학 및 물리적 성질

극성 표면적	0
수소 결합 공여자 수	0
수소 결합 수용자 수	1
회전 가능 결합 수	11
무거운 원자 수	17
형식 전하	0
복잡도	135
물질 분류	Nitrogen Compounds -> Quaternary Amines
화장품	Cosmetic ingredients (Laurtrimonium Bromide) -> CIR (Cosmetic Ingredient Review)Hair conditioningAntistaticPreservative
Physical Description	Dry PowderWhite to light yellow odorless powderHygroscopic[Acros Organics MSDS]
녹는점	246 °C (dec.)(lit.)
밀도	1.1566 (rough estimate)
증기압	0Pa at 20℃
굴절률	1.5260 (estimate)
인화점	246°C
저장 조건	Store below +30°C.
용해도	H2O: 0.1 M at 20 °C, 투명, 무색
물리적 상태	가루
색상	흰색에서 약간 노란색
생물학적 소스	synthetic (oragnic)
용해도	녹는
BRN	3597463
주요 응용	미생물학
화장품 원료 기능	헤어 컨디셔닝항균 방부제
InChI	1S/C15H34N.BrH/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4/h5-15H2,1-4H31H/q+1/p-1
InChIKey	XJWSAJYUBXQQDR-UHFFFAOYSA-M
SMILES	[Br-].CCCCCCCCCCCC[N+](C)(C)C
EPA	1-Dodecanaminium, N,N,N-trimethyl-, bromide (1119-94-4)

화학적 성질

white to slightly yellow powder

안전 및 규제

GHS 분류	This chemical does not meet GHS hazard criteria for 2.2% (2 of 89) of reports.DangerH301 (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.
규제 정보	Chemical: 1-Dodecanaminium, N,N,N-trimethyl-, bromide1-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.
기타 안전 정보	IMAP assessments - Mono- and di-alkyl quaternary ammonium surfactants: Environment tier II assessment
유해성 요약	Causes somnolence and dermatitis in dermal lethal-dose studies of rabbitsCauses other changes in lungs, thorax, or respiration in intravenous lethal-dose studies of mice and rats[RTECS] Oral LD50 (rat) = 200-1,000 mg/kgAn irritant that may cause serious eye injuryHarmful by ingestion, inhalation, and skin absorption[Acros Organics MSDS]
Hazard Classes and Categories	Acute Tox. 3 (20.2%)Acute toxicity - category 4Acute toxicity (Oral) - Category 3
독성 요약	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

용도

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

일반 설명

Dodecyltrimethylammonium bromide is a quaternary ammonium surfactant.