기본 정보
- CAS
15141-18-1- 표준 SMILES
CCN(CCOC(C)=O)c1ccc(N=Nc2ncc([N+](=O)[O-])s2)c(C)c1- InChIKey
HMAJVAFLGGPIPN-UHFFFAOYSA-N- 분자식
- C16H19N5O4S
- 평균 분자량
- 377.4 g/mol
- 단동위원소 질량
- 377.11577509
개요
Disperse Blue 124 is a monoazo compound consisting of diazene with a 5-nitrothiazol-2-yl group attached to one nitrogen and a substituted 4-aminophenyl group attached to the other; used as a dye standard for the assay of allergy-releasing dyes in textiles. It has a role as a dye, an allergen and a hapten. It is a tertiary amine, a member of 1,3-thiazoles and a monoazo compound.
이름 및 식별자
- 우선 이름
- Disperse Blue 124
- IUPAC
- 2-[N-ethyl-3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]anilino]ethyl acetate
- 현지명
- 2-[N-에틸-4-[(5-니트로티아졸-2-일)아조]-m-톨루이디노]에틸아세테이트
- 영어명
- 2-[N-ethyl-4-[(5-nitrothiazol-2-yl)azo]-m-toluidino]ethyl acetate
- 분자식
- C16H19N5O4S
- 분자량
- 377.42
이름 및 동의어
Disperse blue 12461951-51-7CHEBI:59605RefChem:135104239-203-615141-18-1C.I. Disperse Blue 1242-[N-ethyl-3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]anilino]ethyl acetate2-(ethyl{3-methyl-4-[(5-nitro-1,3-thiazol-2-yl)diazenyl]phenyl}amino)ethyl acetateSerisol 2RDEINECS 239-203-6C16H19N5O4S
이름 더 보기
2-[N-에틸-4-[(5-니트로티아졸-2-일)아조]-m-톨루이디노]에틸아세테이트Serisol 3RDHiseperse Blue C-3RC.I.Disperse Blue 124Disperse Yellow Impurity 4Disperse Turquoise Blue FFLHMAJVAFLGGPIPN-VHEBQXMUSA-NDisperse Blue 124 100 μg/mL in Acetonitrile2-[N-ethyl-4-[(5-nitrothiazol-2-yl)azo]-m-toluidino]ethyl acetate
Epitope ID:131801SCHEMBL25292441SCHEMBL30341070DTXSID40864562MSK5838HMAJVAFLGGPIPN-UHFFFAOYSA-NMFCD08056250AKOS015902614
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 141 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 9
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 515
실험 및 물리화학적 성질
Chemical ClassesDyes -> Azo Dyes
물리화학적 성질
- 끓는 점
- 545.7 · 545.7±60.0 °C(Predicted)
- 밀도
- 1.35 · 1.35±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 2.57 · 2.57±0.50(Predicted)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H317: May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P280, P302+P352, P321, P333+P317, P362+P364, and P501 (click each P-code to see the statement)
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P261, P264, P270, P272, P280, P301+P316, P302+P352, P321, P330, P333+P317, P362+P364, P405, and P501 (click each P-code to see the statement)
유해성 정보
Regulatory InformationChemical: Ethanol, 2-[ethyl[3-methyl-4-[2-(5-nitro-2-thiazolyl)diazenyl]phenyl]amino]-, 1-acetate
Hazards SummaryAllergic contact dermatitis reported in textile workers; [Kanerva, p. 1149] Danger of skin sensitization; [MAK]
Hazard Classes and Categories
Skin Sens. 1 (100%)
Acute Tox. 3 (100%)
Skin Sens. 1A
독성 정보
Adverse EffectsSkin Sensitizer - An agent that can induce an allergic reaction in the skin.
안전 데이터
- 기존화학 물질
- KE-07277KE-13963
화학 및 산업
용도 및 제조
Uses
Textiles (Printing, Dyeing, or Finishing) [Category: Industry]
Substance listed with specific concentration in tattoo ink and/or permanent make up according to EU Commission Regulation 2020/2081. The concentration limit (by weight) is 0.1%.
응용 분야
개요Disperse blue 124 is a textile dye responsible for occupational contact dermatitis in the textile industry. A positive patch-test reaction was observed in a painter sensitized to phtalocyanine dyes, with no occupational relevance.
용도Disperse Blue 124 is a disperse textile dye that causes allergic contact dermatitis. It is categorized as an extreme sensitizer and strong irritant. Dyes and metabolites, Environmental Testing
상·하류 제품 정보
상류 원료
공급사20 곳
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
上海艾梯西生物科技有限公司18721763493
常州市华阳科技有限公司+8615250961469 · [email protected]
湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
艾科试剂4008-755-333 18080918076 · [email protected]
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