기본 정보
- CAS
72828-68-3- 표준 SMILES
CC(C)Nc1ccc(Nc2ccc(C(C)(C)C)cc2S(=O)(=O)[O-])c2c1C(=O)c1ccc(S(=O)(=O)[O-])c(O)c1C2=O.[Na+].[Na+]- InChIKey
FSNNTIUWZWTFTK-UHFFFAOYSA-L- 분자식
- C27H26N2Na2O9S2
- 평균 분자량
- 632.6 g/mol
- 단동위원소 질량
- 632.08751132
이름 및 식별자
- 우선 이름
- 2-Anthracenesulfonic acid, 8-((4-(1,1-dimethylethyl)-2-sulfophenyl)amino)-9,10-dihydro-1-hydroxy-5-((1-methylethyl)amino)-9,10-dioxo-, sodium salt
- IUPAC
- disodium;8-(4-tert-butyl-2-sulfonatoanilino)-1-hydroxy-9,10-dioxo-5-(propan-2-ylamino)anthracene-2-sulfonate
- 현지명
- 2-안트라센술폰산,8-[[4-(1,1-디메틸에틸)-2-술포페닐]아미노]-9,10-디히드로-1-히드록시-5-[(1-메틸에틸)아미노]-9,10-디옥소-,나트륨염
- 영어명
- 2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl) -2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1 -methylethyl)amino]-9,10-dioxo-, sodium salt
- 분자식
- C27H28N2O9S2.xNa
- 분자량
- 0
이름 및 동의어
83027-45-672828-68-32-Anthracenesulfonic acid, 8-((4-(1,1-dimethylethyl)-2-sulfophenyl)amino)-9,10-dihydro-1-hydroxy-5-((1-methylethyl)amino)-9,10-dioxo-, sodium salt2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, sodium saltEINECS 280-148-2DTXSID0013517572-Anthracenesulfonic acid, 8-((4-(1,1-dimethylethyl)-2-sulfophenyl)amino)-9,10-dihydro-1-hydroxy-5-((1-methylethyl)amino)-9,10-dioxo-, sodium salt (1:?)8-((4-(1,1-Dimethylethyl)-2-sulfophenyl)amino)-1-hydroxy-5-((1-methylethyl)amino)anthraquinone-2-sulfonic acid, sodium saltDisodium 8-((4-(1,1-dimethylethyl)-2-sulphonatophenyl)amino)-9,10-dihydro-1-hydroxy-5-((1-methylethyl)amino)-9,10-dioxoanthracene-2-sulphonateNS000584802-Anthracenesulfonic acid, 8-((4-(1,1-dimethylethyl)-2-sulfophenyl)amino)-9,10-dihydro-1-hydroxy-5-((1-methylethyl)amino)-9,10-dioxo-, disodium salt2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, sodium salt (1:2)
물성
구조 계산 물성
- 극성 표면적
- 210 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 11
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 42
- 형식 전하
- 0
- 복잡도
- 1,160
물리화학적 성질
- EPA
- 2 · 2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, sodium salt (72828-68-3)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P273, P280, P305+P351+P338, P337+P317, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 9 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory Information
Chemical: 2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, disodium salt
2-Anthracenesulfonic acid, 8-4-(1,1-dimethylethyl)-2-sulfophenylamino-9,10-dihydro-1-hydroxy-5-(1-methylethyl)amino-9,10-dioxo-, disodium salt: 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.
Hazard Classes and CategoriesEye Irrit. 2 (100%)
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information2-Anthracenesulfonic acid, 8-[[4-(1,1-dimethylethyl)-2-sulfophenyl]amino]-9,10-dihydro-1-hydroxy-5-[(1-methylethyl)amino]-9,10-dioxo-, sodium salt (1:?): ACTIVE
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