기본 정보
- CAS
73003-33-5- 표준 SMILES
Cc1nn(-c2ccccc2)c([O-])c1N=Nc1c([O-])cc(S(=O)(=O)[O-])c2ccccc12.Cc1nn(-c2ccccc2)c([O-])c1N=Nc1ccc([N+](=O)[O-])cc1[O-].[Cr+3].[H+].[H+]- InChIKey
XXWGALZQMLZTIY-UHFFFAOYSA-K- 분자식
- C36H26CrN9O9S
- 평균 분자량
- 812.7 g/mol
- 단동위원소 질량
- 812.097924
이름 및 식별자
- 우선 이름
- Chromate(2-), (2,4-dihydro-4-((2-(hydroxy-kappaO)-4-nitrophenyl)azo-kappaN1)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)-kappaO3)(4-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-3-(hydroxy-kappaO)-1-naphthalenesulfonato(3-))-, dihydrogen
- IUPAC
- chromium(3+);hydron;3-methyl-4-[(4-nitro-2-oxidophenyl)diazenyl]-1-phenylpyrazol-5-olate;4-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-3-oxidonaphthalene-1-sulfonate
이름 및 동의어
73003-33-5EINECS 277-197-7Chromate(2-), (2,4-dihydro-4-((2-(hydroxy-kappaO)-4-nitrophenyl)azo-kappaN1)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)-kappaO3)(4-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-3-(hydroxy-kappaO)-1-naphthalenesulfonato(3-))-, dihydrogenChromate(2-), (2,4-dihydro-4-(2-(2-(hydroxy-kappaO)-4-nitrophenyl)diazenyl-kappaN1)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)-kappaO3)(4-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-3-(hydroxy-kappaO)-1-naphthalenesulfonato(3-))-, hydrogen (1:2)Chromate(2-), [2,4-dihydro-4-[[2-(hydroxy-.kappa.O)-4-nitrophenyl]azo-.kappa.N1]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)-.kappa.O3][4-[[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]azo-.kappa.N1]-3-(hydroxy-.kappa.O)-1-naphthalenesulfonato(3-)]-, dihydrogen
데이터베이스 식별자
- CAS
73003-33-5- PubChem CID
- 175367
물성
구조 계산 물성
- 극성 표면적
- 289 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 15
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 56
- 형식 전하
- 0
- 복잡도
- 1,200
화학 및 산업
용도 및 제조
General Manufacturing Information
Chromate(2-), [2,4-dihydro-4-[2-[2-(hydroxy-.kappa.O)-4-nitrophenyl]diazenyl-.kappa.N1]-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-)-.kappa.O3][4-[2-[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]diazenyl-.kappa.N1]-3-(hydroxy-.kappa.O)-1-naphthalenesulfonato(3-)]-, hydrogen (1:2): ACTIVE
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