기본 정보
- CAS
27323-41-7- 표준 SMILES
CCCCCCCCCCCCc1cccc(S(=O)(=O)O)c1.OCCN(CCO)CCO- InChIKey
JHWLWOYSFJIYQV-UHFFFAOYSA-N- 분자식
- C18H30O3S.C6H15NO3
- 평균 분자량
- 475.7 g/mol
- 단동위원소 질량
- 475.29675933
개요
This material contains triethanolamine dodecylbenzenesulfonate, a white- colored, waxy solid dissolved in a liquid carrier. The primary hazard of this material is its potential threat to the environment. Immediate steps should be taken to limit its spread to the environment. Since it is a liquid it can easily penetrate the soil and contaminate groundwater and nearby streams.
이름 및 식별자
- 우선 이름
- dodecylbenzenesulfonic acid, triethanolamine salt
- IUPAC
- 2-[bis(2-hydroxyethyl)amino]ethanol;3-dodecylbenzenesulfonic acid
- 현지명
- 트리에탄올아민 도데실벤젠 술폰산
- 영어명
- TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE
- 분자식
- C18H30O3S.C6H15NO3
- 분자량
- 475.682
이름 및 동의어
Witconate TabTriethanolamine dodecylbenzenesulfonateWitconate 60LWitconate 60TWitconate 79STEA-DodecylbenzenesulfonateWitconate 5725Witconate S-1280Caswell No. 887AAAI3-26730-XDodecylbenzenesulfonic acid triethanolamine saltEINECS 248-406-9
이름 더 보기
트리에탄올아민도데실벤젠설폰산트리에탄올아민도데실벤젠술폰산트리에탄올아민도데실벤젠설폰산(TRIETHANOLAMINEDODECYLBENZENESULFONATE)티이에이-도데실벤젠설포네이트트리에탄올암모늄도데실벤젠술폰산염Alkasurf Twitconate60lwitconate60twitconate79switconatetabwitconate5725witconates-1280TEADODECYLBENZENESULPHONATE
EPA Pesticide Chemical Code 0790208HM7ZD48HNDodecylbenzenesulfonic acid, triethanolamine saltDodecylbenzenesulphonic acid, compound with 2,2',2''-nitrilotriethanol (1:1)DTXSID5027932BENZENESULFONIC ACID, DODECYL-, COMPOUND WITH 2,2',2"-NITRILOTRIS(ETHANOL) (1:1)BENZENESULFONIC ACID, DODECYL-, COMPOUND WITH 2,2',2"-NITRILOTRIS[ETHANOL] (1:1)Witconate S1280
물성
구조 계산 물성
- 극성 표면적
- 127 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 18
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 415
실험 및 물리화학적 성질
Chemical ClassesOther Classes -> Benzenesulfonic Acid Derivatives
Cosmetics
Cosmetic ingredients (TEA-Dodecylbenzenesulfonate) -> CIR (Cosmetic Ingredient Review)
Foaming; Surfactant
Density1.2 at 68 °F (est.) (USCG, 1999) - Denser than water; will sink
Physical Description
This material contains triethanolamine dodecylbenzenesulfonate, a white- colored, waxy solid dissolved in a liquid carrier. The primary hazard of this material is its potential threat to the environment. Immediate steps should be taken to limit its spread to the environment. Since it is a liquid it can easily penetrate the soil and contaminate groundwater and nearby streams.
Other Solid; Liquid
White waxy solid dissolved in a liquid carrier; [CAMEO] 60% Aqueous solution: Yellowish-brown liquid; [CHRIS]
물리화학적 성질
- 안정성
- 안정적인. 타기 쉬운. 강한 산화제와 호환되지 않습니다.
- 화장품 원료 기능
- 세척제발포제계면활성제 - 세정
- InChI
- InChI=1S/C18H30O3S.C6H15NO3/c1-2-3-4-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)22(19,20)21;8-4-1-7(2-5-9)3-6-10/h13-16H,2-12H2,1H3,(H,19,20,21);8-10H,1-6H2
- InChIKey
- JHWLWOYSFJIYQV-UHFFFAOYSA-N
- SMILES
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
This chemical does not meet GHS hazard criteria for 10.2% (70 of 689) of reports.
Danger
H301 (15.2%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P316, P301+P317, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 689 reports by companies from 22 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Benzenesulfonic acid, dodecyl-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenesulfonic acid, dodecyl-, compd. with 2,2',2''-nitrilotris[ethanol] (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)
Benzenesulphonic acid, dodecyl-, compd. with triethanolamine (1:1): Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelClass 9
Fire HazardsSpecial Hazards of Combustion Products: Toxic oxides of nitrogen and irritating oxides of sulfur may form in fire. (USCG, 1999)
Health HazardsIngestion may cause irritation of mouth and stomach. Contact with eyes or prolonged contact with skin may cause irritation. (USCG, 1999)
Hazards Summary
May cause eye and skin (prolonged contact) irritation; [CHRIS] A skin, eye, and respiratory tract irritant; May cause liver, kidney, blood, and CNS injury; [EPA OHM/TADS] Also known as benzenesulfonic acid, C10-13-alkyl derives., compds. With triethanolamine, linear (CAS# 68411-31-4), and as benzenesulfonic acid, dodecyl, branched, compds. With triethanolamine, branched (CAS# 70528-84-6); All 3 CAS#'s and names are currently in use and refer to the same product of commerce; [EPA ChAMP: Submissions - Submission] See Dodecyl benzene sulfonic acid. See Triethanolamine.
화학 및 산업
용도 및 제조
Uses
CIR ingredient: TEA-Dodecylbenzenesulfonate
Used in the chemical, agricultural, and textile processing industries; Used as an intermediate, pesticide, and surface-active agent; [IUCLID] Anionic surfactant used in household, institutional, and industrial cleaning products, emulsion polymerization (i.e. agricultural products), as dye dispersants in the textile industry, in paint strippers, specialized personal care products, and children's bubble making products; [EPA ChAMP: Submissions - Submission] Formerly registered in the US for use as a disinfectant; [NPIRS] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]
Painting (Pigments, Binders, and Biocides) [Category: Paint]
U.S. Production2023: 850,000 - <1,000,000 lb
Consumer UsesSurfactant (surface active agent)
Industry UsesSurfactant (surface active agent)
Household ProductsInformation on 86 consumer products that contain TEA-dodecylbenzenesulfonate in the following categories is provided:
Use ClassificationCosmetics -> Foaming; Surfactant
General Manufacturing Information
Paper Manufacturing
Benzenesulfonic acid, dodecyl-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1): ACTIVE
응용 분야
용도Food additive.
일반 설명TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE contains TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE, a white- colored, waxy solid dissolved in a liquid carrier. The primary hazard of TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE is its potential threat to the environment. Immediate steps should be taken to limit its spread to the environment. Since TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE is a liquid TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE can easily penetrate the soil and contaminate groundwater and nearby streams.
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