1,3-Naphthalenedisulfonic acid, 4-amino-6-[2-[4'-[2-(1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-5-hydroxy-, sodium salt (1:4)
기본 정보
- CAS
68084-23-1- 표준 SMILES
COc1cc(-c2ccc(N=Nc3c(S(=O)(=O)[O-])cc4cc(S(=O)(=O)[O-])cc(O)c4c3O)c(OC)c2)ccc1N=Nc1ccc2c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c(N)c2c1O.[Na+].[Na+].[Na+].[Na+]- InChIKey
JTHOTXPCUHZJCW-UHFFFAOYSA-J- 분자식
- C34H23N5Na4O17S4
- 평균 분자량
- 993.8 g/mol
- 단동위원소 질량
- 992.9562561
이름 및 식별자
- 우선 이름
- 1,3-Naphthalenedisulfonic acid, 4-amino-6-[2-[4'-[2-(1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-5-hydroxy-, sodium salt (1:4)
- IUPAC
- tetrasodium;4-amino-6-[[4-[4-[(1,8-dihydroxy-3,6-disulfonatonaphthalen-2-yl)diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]-5-hydroxynaphthalene-1,3-disulfonate
- 영어명
- tetrasodium 4-amino-6-[[4'-[(1,8-dihydroxy-3,6-disulphonato-2-naphthyl)azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-5-hydroxynaphthalene-1,3-disulphonate
- 분자식
- C34H23N5Na4O17S4
- 분자량
- 993.7888
이름 및 동의어
68084-23-1EINECS 268-434-51,3-Naphthalenedisulfonic acid, 4-amino-6-[[4'-[(1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-5-hydroxy-, tetrasodium salt1,3-Naphthalenedisulfonic acid, 4-amino-6-((4'-((1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)-5-hydroxy-, tetrasodium salt1,3-Naphthalenedisulfonic acid, 4-amino-6-(2-(4'-(2-(1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)diazenyl)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)diazenyl)-5-hydroxy-, sodium salt (1:4)1,3-Naphthalenedisulfonic acid, 4-amino-6-[2-[4'-[2-(1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-5-hydroxy-, sodium salt (1:4)RefChem:415329DTXSID7071074NS00064541Tetrasodium 4-amino-6-((4'-((1,8-dihydroxy-3,6-disulphonato-2-naphthyl)azo)-3,3'-dimethoxy(1,1'-biphenyl)-4-yl)azo)-5-hydroxynaphthalene-1,3-disulphonateTetrasodium 4-amino-6-({4'-[(1,8-dihydroxy-3,6-disulfonatonaphthalen-2-yl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl}diazenyl)-5-hydroxynaphthalene-1,3-disulfonate
물성
구조 계산 물성
- 극성 표면적
- 417 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 22
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 64
- 형식 전하
- 0
- 복잡도
- 1,970
물리화학적 성질
- EPA
- 1 · 1,3-Naphthalenedisulfonic acid, 4-amino-6-[[4'-[(1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)azo]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]azo]-5-hydroxy-, tetrasodium salt (68084-23-1)
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 Information1,3-Naphthalenedisulfonic acid, 4-amino-6-[2-[4'-[2-(1,8-dihydroxy-3,6-disulfo-2-naphthalenyl)diazenyl]-3,3'-dimethoxy[1,1'-biphenyl]-4-yl]diazenyl]-5-hydroxy-, sodium salt (1:4): INACTIVE
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