기본 정보
- CAS
70632-09-6- 표준 SMILES
Cc1cc(-c2ccc(N=Nc3c(N)ccc(N=Nc4ccc(S(=O)(=O)[O-])cc4)c3N)c(C)c2)ccc1N=Nc1ccc(O)c(C(=O)[O-])c1.[Li+].[Li+]- InChIKey
PCIVUQFBACAUBZ-UHFFFAOYSA-L- 분자식
- C33H26Li2N8O6S
- 평균 분자량
- 676.6 g/mol
- 단동위원소 질량
- 676.20160862
이름 및 식별자
- 우선 이름
- Benzoic acid, 5-[2-[4'-[2-[2,6-diamino-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-, lithium salt (1:2)
- IUPAC
- dilithium;5-[[4-[4-[[2,6-diamino-3-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]-3-methylphenyl]-2-methylphenyl]diazenyl]-2-hydroxybenzoate
- 영어명
- dilithium 5-[[4'-[[2,6-diamino-3-[(4-sulphonatophenyl)azo]phenyl]azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]salicylate
- 분자식
- C33H26Li2N8O6S
- 분자량
- 676.55654
이름 및 동의어
70632-09-6EINECS 274-709-0Benzoic acid, 5-[[4'-[[2,6-diamino-3-[(4-sulfophenyl)azo]phenyl]azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, dilithium salt4-((2,6-Diamino-3-((p-sulfophenyl)azo)phenyl)azo)-4'-(5-salicylazo)-3,3'-dimethyl-1,1'-biphenyl, dilithium saltBenzoic acid, 5-((4'-((2,6-diamino-3-((4-sulfophenyl)azo)phenyl)azo)-3,3'-dimethyl(1,1'-biphenyl)-4-yl)azo)-2-hydroxy-, dilithium saltBenzoic acid, 5-(2-(4'-(2-(2,6-diamino-3-(2-(4-sulfophenyl)diazenyl)phenyl)diazenyl)-3,3'-dimethyl(1,1'-biphenyl)-4-yl)diazenyl)-2-hydroxy-, lithium salt (1:2)Benzoic acid, 5-[2-[4'-[2-[2,6-diamino-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-, lithium salt (1:2)RefChem:566076DTXSID8072081NS00063194Dilithium 5-((4'-((2,6-diamino-3-((4-sulphonatophenyl)azo)phenyl)azo)-3,3'-dimethyl(1,1'-biphenyl)-4-yl)azo)salicylateDilithium 5-{[4'-({2,6-diamino-3-[(4-sulfonatophenyl)diazenyl]phenyl}diazenyl)-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl}-2-hydroxybenzoate
물성
구조 계산 물성
- 극성 표면적
- 252 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 14
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 50
- 형식 전하
- 0
- 복잡도
- 1,250
물리화학적 성질
- EPA
- 5 · Benzoic acid, 5-[[4'-[[2,6-diamino-3-[(4-sulfophenyl)azo]phenyl]azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-2-hydroxy-, dilithium salt (70632-09-6)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing InformationBenzoic acid, 5-[2-[4'-[2-[2,6-diamino-3-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]diazenyl]-2-hydroxy-, lithium salt (1:2): INACTIVE
관련 반응
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