기본 정보
- CAS
72639-37-3- 표준 SMILES
O=C(Nc1ccc(N=Nc2ccc(N=Nc3cc(S(=O)(=O)[O-])ccc3S(=O)(=O)[O-])c3cc(S(=O)(=O)[O-])ccc23)c2cccc(S(=O)(=O)[O-])c12)c1ccc2nc(Cl)c(Cl)nc2c1.[Na+].[Na+].[Na+].[Na+]- InChIKey
LYUGIKBHVABFEQ-UHFFFAOYSA-J- 분자식
- C35H17Cl2N7Na4O13S4
- 평균 분자량
- 1,034.7 g/mol
- 단동위원소 질량
- 1,032.8735008
이름 및 식별자
- 우선 이름
- 1,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]diazenyl]-7-sulfo-1-naphthalenyl]diazenyl]-, sodium salt (1:4)
- IUPAC
- tetrasodium;2-[[4-[[4-[(2,3-dichloroquinoxaline-6-carbonyl)amino]-5-sulfonatonaphthalen-1-yl]diazenyl]-7-sulfonatonaphthalen-1-yl]diazenyl]benzene-1,4-disulfonate
- 현지명
- 1,4-벤젠디술폰산,2-[[4-[[4-[[(2,3-디클로로-6-퀴녹살리닐)카르보닐]아미노]-5-술포-1-나프탈레닐]아조]-7-술포-1-나프탈레닐]아조]-,XNUMX나트륨염
- 영어명
- 1,4-Benzenedisulfonic acid, 2-[[4-[[4-[[(2,3-dichloro- 6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl ]azo]-7-sulfo-1-naphthalenyl]azo]-, tetrasodium salt
- 분자식
- C35H21Cl2N7O13S4.4Na
- 분자량
- 1038.72
이름 및 동의어
72639-37-3DTXSID108902371,4-Benzenedisulfonic acid, 2-((4-((4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)azo)-7-sulfo-1-naphthalenyl)azo)-, tetrasodium salt1,4-Benzenedisulfonic acid, 2-(2-(4-(2-(4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)diazenyl)-7-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:4)1,4-Benzenedisulfonic acid, 2-[[4-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-7-sulfo-1-naphthalenyl]azo]-, tetrasodium salt1,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]diazenyl]-7-sulfo-1-naphthalenyl]diazenyl]-, sodium salt (1:4)RefChem:73086DTXCID401079177Tetrasodium 2-[(4-{[4-(2,3-dichloroquinoxaline-6-carboxamido)-5-sulfonatonaphthalen-1-yl]diazenyl}-7-sulfonatonaphthalen-1-yl)diazenyl]benzene-1,4-disulfonate1,4-벤젠디술폰산,2-[[4-[[4-[[(2,3-디클로로-6-퀴녹살리닐)카르보닐]아미노]-5-술포-1-나프탈레닐]아조]-7-술포-1-나프탈레닐]아조]-,XNUMX나트륨염
물성
구조 계산 물성
- 극성 표면적
- 367 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 19
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 65
- 형식 전하
- 0
- 복잡도
- 2,060
물리화학적 성질
- EPA
- 1 · 1,4-Benzenedisulfonic acid, 2-[[4-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-7-sulfo-1-naphthalenyl]azo]-, tetrasodium salt (72639-37-3)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationChemical: 1,4-Benzenedisulfonic acid, 2-[[4-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-7-sulfo-1-naphthalenyl]azo]-, tetrasodium salt
Other Safety InformationIMAP assessments - 1,4-Benzenedisulfonic acid, 2-[[4-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-7-sulfo-1-naphthalenyl]azo]-, tetrasodium salt: Human health tier I assessment
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information1,4-Benzenedisulfonic acid, 2-[2-[4-[2-[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]diazenyl]-7-sulfo-1-naphthalenyl]diazenyl]-, sodium salt (1:4): INACTIVE
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