기본 정보
- CAS
25254-23-3- 표준 SMILES
COc1ccc(N=Nc2c(S(=O)(=O)O)cc3cc(Nc4nc(Cl)nc(Cl)n4)ccc3c2O)c(S(=O)(=O)O)c1- InChIKey
AXIQHVSCTJFZLB-UHFFFAOYSA-N- 분자식
- C20H14Cl2N6O8S2
- 평균 분자량
- 601.4 g/mol
- 단동위원소 질량
- 599.9691592
이름 및 식별자
- 우선 이름
- 7-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methoxy-2-sulfophenyl)diazenyl)-2-naphthalenesulfonic acid
- IUPAC
- 7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)diazenyl]naphthalene-2-sulfonic acid
- 영어명
- 7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(4-methoxy-2-sulphophenyl)azo]naphthalene-2-sulphonic acid
- 분자식
- C20H14Cl2N6O8S2
- 분자량
- 601.4
이름 및 동의어
25254-23-37-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[2-(4-methoxy-2-sulfophenyl)diazenyl]-2-naphthalenesulfonic acid7-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-(2-(4-methoxy-2-sulfophenyl)diazenyl)-2-naphthalenesulfonic acidRefChem:310036EINECS 246-763-57-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)-4-hydroxy-3-((4-methoxy-2-sulphophenyl)azo)naphthalene-2-sulphonic acidSCHEMBL3697527SCHEMBL4166597AXIQHVSCTJFZLB-UHFFFAOYSA-NDTXSID901105408NS000494557-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]-2-naphthalenesulfonic acid
이름 더 보기
7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(4-methoxy-2-sulphophenyl)azo]naphthalene-2-sulphonic acid2-Naphthalenesulfonic acid, 7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[2-(4-methoxy-2-sulfophenyl)diazenyl]-
데이터베이스 식별자
- CAS
25254-23-3- PubChem CID
- 91359
- DTXSID
DTXSID901105408- EC Number
- 246-763-5
- Nikkaji
- J236.106J
물성
구조 계산 물성
- XLogP
- 3.9
- 극성 표면적
- 230 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 14
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 1,050
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationChemical: 2-Naphthalenesulfonic acid, 7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]-
Other Safety InformationIMAP assessments - 2-Naphthalenesulfonic acid, 7-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]-4-hydroxy-3-[(4-methoxy-2-sulfophenyl)azo]-: Human health tier I assessment
관련 반응
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