기본 정보
- CAS
68834-02-6- 표준 SMILES
Cc1ccc(S(=O)(=O)Oc2ccc(Nc3cc(S(=O)(=O)O)c(N)c4c3C(=O)c3ccccc3C4=O)cc2)cc1- InChIKey
FDEABYDIRZEBLW-UHFFFAOYSA-N- 분자식
- C27H20N2O8S2
- 평균 분자량
- 564.6 g/mol
- 단동위원소 질량
- 564.06610795
이름 및 식별자
- 우선 이름
- 2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]amino]-9,10-dioxo-
- IUPAC
- 1-amino-4-[4-(4-methylphenyl)sulfonyloxyanilino]-9,10-dioxoanthracene-2-sulfonic acid
- 영어명
- 1-amino-9,10-dihydro-4-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]amino]-9,10-dioxoanthracene-2-sulphonic acid
- 분자식
- C27H20N2O8S2
- 분자량
- 564.5863
이름 및 동의어
EINECS 272-428-82-Anthracenesulfonic acid, 1-amino-4-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]amino]-9,10-dihydro-9,10-dioxo-2-Anthracenesulfonic acid, 1-amino-4-((4-(((4-methylphenyl)sulfonyl)oxy)phenyl)amino)-9,10-dihydro-9,10-dioxo-2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-(((4-methylphenyl)sulfonyl)oxy)phenyl)amino)-9,10-dioxo-2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-((4-((4-methylphenyl)sulfonyloxy)phenyl)amino)-9,10-dioxo-1-Amino-9,10-dihydro-4-((4-(((4-methylphenyl)sulphonyl)oxy)phenyl)amino)-9,10-dioxoanthracene-2-sulphonic acid1-Amino-9,10-dihydro-4-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]amino]-9,10-dioxo-2-anthracenesulfonic acid1-amino-9,10-dihydro-4-[[4-[[(4-methylphenyl)sulphonyl]oxy]phenyl]amino]-9,10-dioxoanthracene-2-sulphonic acid2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]amino]-9,10-dioxo-1-Amino-9,10-dihydro-4-((4-(((4-methylphenyl)sulfonyl)oxy)phenyl)amino)-9,10-dioxo-2-anthracenesulfonic acidRefChem:465312272-428-8
물성
구조 계산 물성
- XLogP
- 5
- 극성 표면적
- 187 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 1,130
물리화학적 성질
- EPA
- 2 · 2-Anthracenesulfonic acid, 1-amino-4-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]amino]-9,10-dihydro-9,10-dioxo- (68834-02-6)
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% (3 of 3) of all reports.
Not Classified
Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesNot Classified
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information2-Anthracenesulfonic acid, 1-amino-9,10-dihydro-4-[[4-[[(4-methylphenyl)sulfonyl]oxy]phenyl]amino]-9,10-dioxo-: INACTIVE
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…