기본 정보
- CAS
72829-12-0- 표준 SMILES
Cc1cc(N=Nc2ccc(S(=O)(=O)[O-])cc2)c(N)c(N=Nc2ccc(NC(=O)c3ccc(N=Nc4ccc(O)c(C(=O)[O-])c4)cc3)cc2)c1N.[Na+].[Na+]- InChIKey
IDQIUSUZMLRVBZ-UHFFFAOYSA-L- 분자식
- C33H25N9Na2O7S
- 평균 분자량
- 737.7 g/mol
- 단동위원소 질량
- 737.13930391
이름 및 식별자
- 우선 이름
- Benzoic acid, 5-[2-[4-[[[4-[2-[2,6-diamino-3-methyl-5-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]amino]carbonyl]phenyl]diazenyl]-2-hydroxy-, sodium salt (1:2)
- IUPAC
- disodium;5-[[4-[[4-[[2,6-diamino-3-methyl-5-[(4-sulfonatophenyl)diazenyl]phenyl]diazenyl]phenyl]carbamoyl]phenyl]diazenyl]-2-hydroxybenzoate
- 영어명
- disodium 5-[[4-[[[4-[[2,6-diamino-3-methyl-5-[(4-sulphonatophenyl)azo]phenyl]azo]phenyl]amino]carbonyl]phenyl]azo]salicylate
- 분자식
- C33H25N9Na2O7S
- 분자량
- 737.65224
이름 및 동의어
72829-12-0DTXSID60890121EINECS 276-904-6Benzoic acid, 5-((4-(((4-((2,6-diamino-3-methyl-5-((4-sulfophenyl)azo)phenyl)azo)phenyl)amino)carbonyl)phenyl)azo)-2-hydroxy-, disodium saltBenzoic acid, 5-(2-(4-(((4-(2-(2,6-diamino-3-methyl-5-(2-(4-sulfophenyl)diazenyl)phenyl)diazenyl)phenyl)amino)carbonyl)phenyl)diazenyl)-2-hydroxy-, sodium salt (1:2)Benzoic acid, 5-[2-[4-[[[4-[2-[2,6-diamino-3-methyl-5-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]amino]carbonyl]phenyl]diazenyl]-2-hydroxy-, sodium salt (1:2)Benzoic acid, 5-[[4-[[[4-[[2,6-diamino-3-methyl-5-[(4-sulfophenyl)azo]phenyl]azo]phenyl]amino]carbonyl]phenyl]azo]-2-hydroxy-, disodium saltRefChem:118484DTXCID701079045Disodium 5-((4-(((4-((2,6-diamino-3-methyl-5-((4-sulphonatophenyl)azo)phenyl)azo)phenyl)amino)carbonyl)phenyl)azo)salicylateNS00090701Disodium 5-[(4-{[4-({2,6-diamino-3-methyl-5-[(4-sulfonatophenyl)diazenyl]phenyl}diazenyl)phenyl]carbamoyl}phenyl)diazenyl]-2-hydroxybenzoate
이름 더 보기
disodium 5-[[4-[[[4-[[2,6-diamino-3-methyl-5-[(4-sulphonatophenyl)azo]phenyl]azo]phenyl]amino]carbonyl]phenyl]azo]salicylate5-[[4-[[[4-[[2,6-Diamino-3-methyl-5-[(4-sulfophenyl)azo]phenyl]azo]phenyl]amino]carbonyl]phenyl]azo]-2-hydroxybenzoic acid disodium saltdisodium (3E)-3-[[4-[[4-[2,6-diamino-3-methyl-5-(4-sulfonatophenyl)diazenyl-phenyl]diazenylphenyl]carbamoyl]phenyl]hydrazinylidene]-6-oxo-cyclohexa-1,4-diene-1-carboxylate
데이터베이스 식별자
- CAS
72829-12-0- PubChem CID
- 175193
- DTXSID
DTXSID60890121- EC Number
- 276-904-6
물성
구조 계산 물성
- 극성 표면적
- 281 Ų
- 수소 결합 공여자 수
- 4
- 수소 결합 수용자 수
- 15
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 52
- 형식 전하
- 0
- 복잡도
- 1,320
물리화학적 성질
- EPA
- 5 · Benzoic acid, 5-[[4-[[[4-[[2,6-diamino-3-methyl-5-[(4-sulfophenyl)azo]phenyl]azo]phenyl]amino]carbonyl]phenyl]azo]-2-hydroxy-, disodium salt (72829-12-0)
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-[[[4-[2-[2,6-diamino-3-methyl-5-[2-(4-sulfophenyl)diazenyl]phenyl]diazenyl]phenyl]amino]carbonyl]phenyl]diazenyl]-2-hydroxy-, sodium salt (1:2): INACTIVE
공급사1 곳
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