기본 정보
- CAS
14954-75-7- 표준 SMILES
CC1=NN(c2ccccc2)C(=O)C1N=Nc1c(O)cc(S(=O)(=O)O)c2ccccc12- InChIKey
GQCUEANXEKPQGU-UHFFFAOYSA-N- 분자식
- C20H16N4O5S
- 평균 분자량
- 424.4 g/mol
- 단동위원소 질량
- 424.0841408
이름 및 식별자
- 우선 이름
- 1-Naphthalenesulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-3-hydroxy-
- IUPAC
- 3-hydroxy-4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalene-1-sulfonic acid
이름 및 동의어
DTXSID908632271-Naphthalenesulfonic acid, 4-(2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl)-3-hydroxy-1-Naphthalenesulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-3-hydroxy-RefChem:434880DTXCID3081188314954-75-71-Naphthalenesulfonic acid, 4-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-3-hydroxy-Acid Chrome Bordeaux BC.I. Mordant Red 7Acid Chrome Bordeaux 2A1-Naphthalenesulfonic acid, 4-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-3-hydroxy-NSC47717
이름 더 보기
C.I. 18760UNII-87R9RU27MV4-[[(4,5-Dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol)-4-yl]azo]-3-hydroxy-1-naphthalenesulfonic acidSCHEMBL162722SCHEMBL2549358SCHEMBL7601826GQCUEANXEKPQGU-UHFFFAOYSA-N3-hydroxy-4-[(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]naphthalene-1-sulfonic acid
데이터베이스 식별자
- CAS
14954-75-7
물성
구조 계산 물성
- XLogP
- 3
- 극성 표면적
- 140 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 818
화학 및 산업
용도 및 제조
General Manufacturing Information1-Naphthalenesulfonic acid, 4-[2-(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)diazenyl]-3-hydroxy-: INACTIVE
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