기본 정보
- CAS
68195-63-1- 표준 SMILES
CC1=NN(c2ccccc2)C(=O)C1(c1c(C)[nH]n(-c2ccccc2)c1=O)c1c(C)[nH]n(-c2ccccc2)c1=O- InChIKey
NJMSAXXLZUMLAT-UHFFFAOYSA-N- 분자식
- C30H26N6O3
- 평균 분자량
- 518.6 g/mol
- 단동위원소 질량
- 518.20663871
이름 및 식별자
- 우선 이름
- 5,5''-Dihydroxy-3,3'',5'-trimethyl-1,1'',2'-triphenyl-1H,1''H-[4,4':4',4''-terpyrazol]-3'(2'H)-one
- IUPAC
- 5-methyl-4,4-bis(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-phenylpyrazol-3-one
- 현지명
- 에다라보네
- 영어명
- Edaravone
- 분자식
- C30H26N6O3
- 분자량
- 518.57
이름 및 동의어
124009-63-85,5''-Dihydroxy-3,3'',5'-trimethyl-1,1'',2'-triphenyl-1H,1''H-[4,4':4',4''-terpyrazol]-3'(2'H)-oneMFCD280165425-methyl-4,4-bis(5-methyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-2-phenylpyrazol-3-one2,4-Dihydro-4,4-bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-methyl-2-phenyl-3H-pyrazol-3-one3h-pyrazol-3-one,2,4-dihydro-4,4-bis(5-hydroxy-3-methyl-1-phenyl-1h-pyrazol-4-yl)-5-methyl-2-phenyl-3H-Pyrazol-3-one, 2,4-dihydro-4,4-bis(5-hydroxy-3-Methyl- 1-phenyl-1H-pyrazol-4-yl)-5-Methyl-2-phenyQD3GWF6HFZEdaravone Trimer ImpuritySCHEMBL310478983H-Pyrazol-3-one, 2,4-dihydro-4,4-bis(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)-5-methyl-2-phenyl-AC-30012
이름 더 보기
에다라보네3,3'',5'-trimethyl-1,1'',2'-triphenyl4,4-Bis-(3-methyl-phenyl-pyrazolin-5-on-4-yl)-3-methyl-1-phenyl-pyrazolin-5-on5-methyl-4,4-bis(3-methyl-5-oxo-1-phenyl-4H-pyrazol-4-yl)-2-phenylpyrazol-3-one5,5',5''-Trimethyl-2,2',2''-triphenyl-[4,4':4',4''-ter-4H-pyrazole]-3,3',3''(2H,2'H,2''H)-trione
물성
구조 계산 물성
- XLogP
- 4.3
- 극성 표면적
- 97.4 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 1,080
물리화학적 성질
- 녹는점
- 200 °C · 200 °C (decomp)(Solv: ethanol (64-17-5))
- 끓는 점
- 770.6 · 770.6±60.0 °C(Predicted)
- 밀도
- 1.34 · 1.34±0.1 g/cm3(Predicted)
- 용해도
- DMSO(약간 용해됨), 메탄올(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 2.15 · 2.15±0.70(Predicted)
- 색상
- 흰색에서 황백색까지
화학 및 산업
응용 분야
용도Edaravone Trimer is an impurity of Edaravone ( ). Edaravone is an intravenous medication used to help with recovery following a stroke and to treat amyotrophic lateral sclerosis.
상·하류 제품 정보
하류 제품
공급사40 곳
天津始加生物医药科技有限公司15022261580 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
怀化元研达生物技术有限责任公司18711085600 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
广州蓝宁生物科技有限公司15813355568 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
深圳市简一生物科技有限公司0755-84826604 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
上海柯维化学技术有限公司
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