1,5-naphthalenedisulfonic acid, 2-((8-((4-chloro-6-((2-((4-chloro-6-((8-hydroxy-3,6-disulfo-7-((2-sulfophenyl)azo)-1-naphthalenyl)amino)-1,3,5-triazin-2-yl)amino)ethyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, potassium sodium salt
기본 정보
- CAS
84041-86-1- 표준 SMILES
O=S(=O)(O)c1cc(Nc2nc(Cl)nc(NCCNc3nc(Cl)nc(Nc4cc(S(=O)(=O)O)cc5cc(S(=O)(=O)O)c(N=Nc6ccc7c(S(=O)(=O)O)cccc7c6S(=O)(=O)O)c(O)c45)n3)n2)c2c(O)c(N=Nc3ccccc3S(=O)(=O)O)c(S(=O)(=O)O)cc2c1.[K+].[Na+]- InChIKey
VJMSMMVVQSFLMQ-OTGFOSAPSA-N- 분자식
- C44H32Cl2KN14NaO23S7+2
- 평균 분자량
- 1,482.3 g/mol
- 단동위원소 질량
- 1,479.8721527
이름 및 식별자
- 우선 이름
- 1,5-naphthalenedisulfonic acid, 2-((8-((4-chloro-6-((2-((4-chloro-6-((8-hydroxy-3,6-disulfo-7-((2-sulfophenyl)azo)-1-naphthalenyl)amino)-1,3,5-triazin-2-yl)amino)ethyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, potassium sodium salt
- IUPAC
- potassium;sodium;5-[[4-chloro-6-[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)diazenyl]naphthalen-1-yl]amino]-1,3,5-triazin-2-yl]amino]ethylamino]-1,3,5-triazin-2-yl]amino]-3-[(1,5-disulfonaphthalen-2-yl)diazenyl]-4-hydroxynaphthalene-2,7-disulfonic acid
- 영어명
- 1,5-Naphthalenedisulfonic acid,2-[[8-[[4-chloro-6-[[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)azo]-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-,potas
- 분자식
- C44H32Cl2KN14NaO23S7+2
- 분자량
- 1482.25395
이름 및 동의어
1,5-Naphthalenedisulfonic acid, 2-((8-((4-chloro-6-((2-((4-chloro-6-((8-hydroxy-3,6-disulfo-7-((2-sulfophenyl)azo)-1-naphthalenyl)amino)-1,3,5-triazin-2-yl)amino)ethyl)amino)-1,3,5-triazin-2-yl)amino)-1-hydroxy-3,6-disulfo-2-naphthalenyl)azo)-, potassium sodium salt84041-86-11,5-Naphthalenedisulfonic acid, 2-[[8-[[4-chloro-6-[[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)azo]-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, potassium sodium saltRefChem:417340KTEBWCRPGKJHNE-UHFFFAOYSA-N1,5-Naphthalenedisulfonic acid,2-[[8-[[4-chloro-6-[[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)azo]-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-,potas1,5-Naphthalenedisulfonic acid, 2-[[8-[[4-chloro-6-[[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)azo]-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, potassium
물성
구조 계산 물성
- 극성 표면적
- 655 Ų
- 수소 결합 공여자 수
- 13
- 수소 결합 수용자 수
- 37
- 회전 가능 결합 수
- 20
- 무거운 원자 수
- 92
- 형식 전하
- 2
- 복잡도
- 3,420
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory Information
Chemical: 1,5-Naphthalenedisulfonic acid, 2-[[8-[[4-chloro-6-[[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)azo]-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, potassium sodium salt
REACH registered substance: 1,5-Naphthalenedisulfonic acid, 2-[[8-[[4-chloro-6-[[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)azo]-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, potassium (EC: 400-190-9)
Other Safety Information
IMAP assessments - 1,5-Naphthalenedisulfonic acid, 2-[[8-[[4-chloro-6-[[2-[[4-chloro-6-[[8-hydroxy-3,6-disulfo-7-[(2-sulfophenyl)azo]-1-naphthalenyl]amino]-1,3,5-triazin-2-yl]amino]ethyl]amino]-1,3,5-triazin-2-yl]amino]-1-hydroxy-3,6-disulfo-2-naphthalenyl]azo]-, potassium sodium salt: Human health tier I assessment
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…