기본 정보
- CAS
16823-51-1- 표준 SMILES
Nc1c(S(=O)(=O)O)cc(Nc2ccc(S(=O)(=O)O)c(Nc3nc(Cl)nc(Nc4cccc(S(=O)(=O)O)c4)n3)c2)c2c1C(=O)c1ccccc1C2=O- InChIKey
NSDSIQGBHACTLY-UHFFFAOYSA-N- 분자식
- C29H20ClN7O11S3
- 평균 분자량
- 774.2 g/mol
- 단동위원소 질량
- 773.0071457
개요
Reactive Blue 5 is anthraquinone carrying amino, sulfo and [3-({4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl}amino)-4-sulfophenyl]amino substituents at positions 1, 2 and 4 respectively. It has a role as a dye. It is a conjugate acid of a Reactive Blue 5(3-).
이름 및 식별자
- 우선 이름
- 1-Amino-4-((3-((4-chloro-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-2-anthracenesulfonic acid
- IUPAC
- 1-amino-4-[3-[[4-chloro-6-(3-sulfoanilino)-1,3,5-triazin-2-yl]amino]-4-sulfoanilino]-9,10-dioxoanthracene-2-sulfonic acid
- 현지명
- REACTIVE 청색 5
- 영어명
- REACTIVE BLUE 5
- 분자식
- C29H20ClN7O11S3
- 분자량
- 774.16
이름 및 동의어
Reactive Blue 516823-51-1Procion brilliant blue hgrDTXSID5066118CHEBI:613112-Anthracenesulfonic acid, 1-amino-4-((3-((4-chloro-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-sulfophenyl)amino)-9,10-dihydro-9,10-dioxo-2-Anthracenesulfonic acid, 1-amino-4-[[3-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-1-Amino-4-{[3-({4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl}amino)-4-sulfophenyl]amino}-9,10-dihydro-9,10-dioxoanthracene-2-sulfonic acid1-Amino-4-((3-((4-chloro-6-((3-sulfophenyl)amino)-1,3,5-triazin-2-yl)amino)-4-sulfophenyl)amino)-9,10-dihydro-9,10-dioxoanthracene-2-sulfonic acidRefChem:878958procion brillant blue H5GSprocion brilliant blue HGRS
이름 더 보기
REACTIVE청색5REACTIVE청색5(REACTIVEBLUE5)RB-5Brill. Blue K-GRReactive Blue BRC.I.Reactiveblue5Everzol Blue P-GR
물성
구조 계산 물성
- XLogP
- 4.4
- 극성 표면적
- 323 Ų
- 수소 결합 공여자 수
- 7
- 수소 결합 수용자 수
- 18
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 51
- 형식 전하
- 0
- 복잡도
- 1,640
실험 및 물리화학적 성질
Chemical ClassesDyes -> Anthraquinone Dyes
Physical DescriptionSolid; [Sigma-Aldrich MSDS]
물리화학적 성질
- 밀도
- 1.845 · 1.845±0.06 g/cm3(Predicted)
- 산도 계수 (pKa)
- -1.22 · -1.22±0.20(Predicted)
- EPA
- 2 · 2-Anthracenesulfonic acid, 1-amino-4-[[3-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo- (16823-51-1)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS ClassificationNot Classified
유해성 정보
Regulatory Information
Chemical: 2-Anthracenesulfonic acid, 1-amino-4-[[3-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-
2-Anthracenesulfonic acid, 1-amino-4-3-4-chloro-6-(3-sulfophenyl)amino-1,3,5-triazin-2-ylamino-4-sulfophenylamino-9,10-dihydro-9,10-dioxo-: 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 InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazards SummaryMay cause irritation; [Sigma-Aldrich MSDS] See C.I. Reactive Blue 19.
Hazard Classes and CategoriesNot Classified
안전 데이터
- wgk
- 3
- tsca
- TSCA listed
- 기존화학 물질
- KE-08100
화학 및 산업
용도 및 제조
General Manufacturing Information2-Anthracenesulfonic acid, 1-amino-4-[[3-[[4-chloro-6-[(3-sulfophenyl)amino]-1,3,5-triazin-2-yl]amino]-4-sulfophenyl]amino]-9,10-dihydro-9,10-dioxo-: INACTIVE
상·하류 제품 정보
상류 원료
공급사16 곳
郑州阿尔法化工有限公司+86-18530059196 · [email protected]
超彩实业有限公司0574-83851061 · [email protected]
上海将来实业股份有限公司400-0066400 13621662912 · [email protected]
Alfa Chemistry1-516-6625404 · [email protected]
上海新平精细化学品有限公司18221735425 · [email protected]
湖北诺纳科技有限公司027-59209883 17386138556 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
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