Tripotassium p-(4,5-dihydro-3-methyl-4-(5-(3-methyl-5-oxido-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)penta-2,4-dienylidene)-5-oxo-1H-pyrazol-1-yl)benzenesulphonate
기본 정보
- CAS
63811-37-0- 표준 SMILES
CC1=NN(c2ccc(S(=O)(=O)[O-])cc2)C(=O)\C1=C/C=C/C=C/c1c(C)nn(-c2ccc(S(=O)(=O)[O-])cc2)c1[O-].[K+].[K+].[K+]- InChIKey
HLFYUTAYQZNBGU-FWABMVGRSA-K- 분자식
- C25H19K3N4O8S2
- 평균 분자량
- 684.9 g/mol
- 단동위원소 질량
- 683.9555504
이름 및 식별자
- 우선 이름
- Tripotassium p-(4,5-dihydro-3-methyl-4-(5-(3-methyl-5-oxido-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)penta-2,4-dienylidene)-5-oxo-1H-pyrazol-1-yl)benzenesulphonate
- IUPAC
- tripotassium;4-[3-methyl-4-[(1E,3E,5Z)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]penta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonate
- 영어명
- tripotassium p-[4,5-dihydro-3-methyl-4-[5-[3-methyl-5-oxido-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]penta-2,4-dienylidene]-5-oxo-1H-pyrazol-1-yl]benzenesulphonate
- 분자식
- C25H19K3N4O8S2
- 분자량
- 684.86526
이름 및 동의어
EINECS 264-469-563811-37-0Tripotassium p-(4,5-dihydro-3-methyl-4-(5-(3-methyl-5-oxido-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl)penta-2,4-dienylidene)-5-oxo-1H-pyrazol-1-yl)benzenesulphonateHLFYUTAYQZNBGU-FWABMVGRSA-K4-[3-methyl-4-[(1E,3E,5E)-5-[3-methyl-5-oxo-1-(4-sulfonatophenyl)pyrazol-4-ylidene]penta-1,3-dienyl]-5-oxidopyrazol-1-yl]benzenesulfonatetripotassium p-[4,5-dihydro-3-methyl-4-[5-[3-methyl-5-oxido-1-(4-sulphonatophenyl)-1H-pyrazol-4-yl]penta-2,4-dienylidene]-5-oxo-1H-pyrazol-1-yl]benzenesulphonate4-[[4,5-Dihydro-4-[5-[[5-potassiooxy-3-methyl-1-(4-potassiosulfophenyl)-1H-pyrazol]-4-yl]-2,4-pentadienylidene]-3-methyl-5-oxo-1H-pyrazol]-1-yl]benzenesulfonic acid potassium salt
데이터베이스 식별자
- CAS
63811-37-0- PubChem CID
- 44148298
- EC Number
- 264-469-5
물성
구조 계산 물성
- 극성 표면적
- 205 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 42
- 형식 전하
- 0
- 복잡도
- 1,130
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…