기본 정보
- CAS
72639-29-3- 표준 SMILES
O=C(Nc1ccc(N=Nc2cc(S(=O)(=O)[O-])c3cc(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c3c2)c2cccc(S(=O)(=O)[O-])c12)c1ccc2nc(Cl)c(Cl)nc2c1.[Na+].[Na+].[Na+].[Na+]- InChIKey
VPMRIEZGYICHGJ-UHFFFAOYSA-J- 분자식
- C29H13Cl2N5Na4O13S4
- 평균 분자량
- 930.6 g/mol
- 단동위원소 질량
- 928.8360527
이름 및 식별자
- 우선 이름
- 1,3,5-Naphthalenetrisulfonic acid, 7-[2-[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]diazenyl]-, sodium salt (1:4)
- IUPAC
- tetrasodium;7-[[4-[(2,3-dichloroquinoxaline-6-carbonyl)amino]-5-sulfonatonaphthalen-1-yl]diazenyl]naphthalene-1,3,5-trisulfonate
- 영어명
- tetrasodium 7-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulphonato-1-naphthyl]azo]naphthalene-1,3,5-trisulphonate
- 분자식
- C29H18Cl2N5NaO13S4
- 분자량
- 866.61
이름 및 동의어
72639-29-3EINECS 276-752-0DTXSID508902311,3,5-Naphthalenetrisulfonic acid, 7-((4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)azo)-, tetrasodium salt1,3,5-Naphthalenetrisulfonic acid, 7-(2-(4-(((2,3-dichloro-6-quinoxalinyl)carbonyl)amino)-5-sulfo-1-naphthalenyl)diazenyl)-, sodium salt (1:4)8-(((2,3-Dichloroquinoxalin-6-yl)carbonyl)amino)-5-((1,3,5-trisulfo-7-naphthyl)azo)-1-naphthalenesulfonic acid, tetrasodium salt1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-, tetrasodium salt1,3,5-Naphthalenetrisulfonic acid, 7-[2-[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]diazenyl]-, sodium salt (1:4)RefChem:72281DTXCID1010791667-4-(2,3-dichloro-6-quinoxalinyl)carbonylamino-5-sulphonato-1-naphthylazonaphthalene-1,3,5-trisulphonate (sodium salt)NS00062331
이름 더 보기
C.I. Reactive Orange 30VPMRIEZGYICHGJ-UEVOHEPMSA-J
물성
구조 계산 물성
- 극성 표면적
- 342 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 17
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 57
- 형식 전하
- 0
- 복잡도
- 1,800
물리화학적 성질
- EPA
- 1 · 1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-, tetrasodium salt (72639-29-3)
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 100% (8 of 8) of all reports.
Not Classified
Aggregated GHS information provided per 8 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Regulatory InformationChemical: 1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-, tetrasodium salt
Other Safety InformationIMAP assessments - 1,3,5-Naphthalenetrisulfonic acid, 7-[[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]azo]-, tetrasodium salt: Human health tier I assessment
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information1,3,5-Naphthalenetrisulfonic acid, 7-[2-[4-[[(2,3-dichloro-6-quinoxalinyl)carbonyl]amino]-5-sulfo-1-naphthalenyl]diazenyl]-, sodium salt (1:4): ACTIVE
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