기본 정보
- CAS
73514-04-2- 표준 SMILES
Cc1nn(-c2ccccc2)c([O-])c1N=Nc1cc([N+](=O)[O-])cc(S(=O)(=O)[O-])c1[O-].O=C1C=Cc2ccccc2C1=NN=C1C(=O)C=C(S(=O)(=O)[O-])c2cc(N([O-])[O-])ccc21.[Cr+3].[NH4+].[NH4+].[NH4+]- InChIKey
UFHAZCZIDGJCGU-RMCKZSDJSA-M- 분자식
- C36H32CrN11O14S2
- 평균 분자량
- 958.8 g/mol
- 단동위원소 질량
- 958.097667
이름 및 식별자
- 우선 이름
- Chromate(3-), (3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(3-(hydroxy-kappaO)-4-((2-(hydroxy-kappaO)-1-naphthalenyl)azo-kappaN1)-7-nitro-1-naphthalenesulfonato(3-))-, triammonium
- IUPAC
- triazanium;chromium(3+);7-(dioxidoamino)-3-oxo-4-[(2-oxonaphthalen-1-ylidene)hydrazinylidene]naphthalene-1-sulfonate;3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate
- 영어명
- Chromate(3-), [3-[(4,5-dihydro-3-methyl- 5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-2-hydroxy-5-nitrobenzenesulfonato (3-)][3-hydroxy-4-[(2-hydrox y-1-naphthalenyl)azo]-7-nitro-1-naphthalenesulfona to(3-)]-, triammonium
- 분자식
- C36H32CrN11O14S2
- 분자량
- 958.83068
이름 및 동의어
73514-04-2Chromate(3-), (3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxy-5-nitrobenzenesulfonato(3-))(3-hydroxy-4-((2-hydroxy-1-naphthalenyl)azo)-7-nitro-1-naphthalenesulfonato(3-))-, triammoniumChromate(3-), (3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(3-(hydroxy-kappaO)-4-((2-(hydroxy-kappaO)-1-naphthalenyl)azo-kappaN1)-7-nitro-1-naphthalenesulfonato(3-))-, triammoniumDTXSID701015409Chromate(3-), (3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(3-(hydroxy-kappaO)-4-(2-(2-(hydroxy-kappaO)-1-naphthalenyl)diazenyl-kappaN1)-7-nitro-1-naphthalenesulfonato(3-))-, ammonium (1:3)Chromate(3-), [3-[[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]azo-.kappa.N1]-2-(hydroxy-.kappa.O)-5-nitrobenzenesulfonato(3-)][3-(hydroxy-.kappa.O)-4-[[2-(hydroxy-.kappa.O)-1-naphthalenyl]azo-.kappa.N1]-7-nitro-1-naphthalenesulfonato(3-)]-, triammonium
물성
구조 계산 물성
- 극성 표면적
- 377 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 20
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 64
- 형식 전하
- 0
- 복잡도
- 1,700
물리화학적 성질
- EPA
- 3 · Chromate(3-), [3-[[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]azo-.kappa.N1]-2-(hydroxy-.kappa.O)-5-nitrobenzenesulfonato(3-)][3-(hydroxy-.kappa.O)-4-[[2-(hydroxy-.kappa.O)-1-naphthalenyl]azo-.kappa.N1]-7-nitro-1-naphthalenesulfonato(3-)]-, triammonium (73514-04-2)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- tsca
- TSCA listed
- 기존화학 물질
- KE-10711
화학 및 산업
용도 및 제조
General Manufacturing Information
Chromate(3-), [3-[2-[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]diazenyl-.kappa.N1]-2-(hydroxy-.kappa.O)-5-nitrobenzenesulfonato(3-)][3-(hydroxy-.kappa.O)-4-[2-[2-(hydroxy-.kappa.O)-1-naphthalenyl]diazenyl-.kappa.N1]-7-nitro-1-naphthalenesulfonato(3-)]-, ammonium (1:3): ACTIVE
관련 반응
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