4,4'-((3,3'-Dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(2,1-diazenediyl))bis(2,4-dihydro-5-methyl-2-(4-methylphenyl)-3H-pyrazol-3-one)
기본 정보
- CAS
6883-91-6- 표준 SMILES
COc1cc(-c2ccc(N=Nc3c(C)nn(-c4ccc(C)cc4)c3O)c(OC)c2)ccc1N=Nc1c(C)nn(-c2ccc(C)cc2)c1O- InChIKey
AYMLQIPGKSDOHC-UHFFFAOYSA-N- 분자식
- C36H34N8O4
- 평균 분자량
- 642.7 g/mol
- 단동위원소 질량
- 642.2703016
이름 및 식별자
- 우선 이름
- 4,4'-((3,3'-Dimethoxy(1,1'-biphenyl)-4,4'-diyl)bis(2,1-diazenediyl))bis(2,4-dihydro-5-methyl-2-(4-methylphenyl)-3H-pyrazol-3-one)
- IUPAC
- 4-[[4-[4-[[5-hydroxy-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]diazenyl]-3-methoxyphenyl]-2-methoxyphenyl]diazenyl]-3-methyl-1-(4-methylphenyl)pyrazol-5-ol
- 영어명
- 4,4'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[2,4-dihydro-5-methyl-2-(p-tolyl)-3H-pyrazol-3-one]
- 분자식
- C36H34N8O4
- 분자량
- 642.70636
이름 및 동의어
VULCAN FAST RED GCI 21205CI.21205C.I. 21205Q272705672-PYRAZOLIN-5-ONE, 4,4'-(3,3'-DIMETHOXY-4,4'-BIPHENYLYLENEBISAZO)BIS(3-METHYL-1-P-TOLYL-4,4'-((3,3'-DIMETHOXY(1,1'-BIPHENYL)-4,4'-DIYL)BIS(2,1-DIAZENEDIYL))BIS(2,4-DIHYDRO-5-METHYL-2-(4-METHYLPHENYL)-3H-PYRAZOL-3-ONE)C.I.21205Pigment Red 37Polymo Scarlet GRC.I. Pigment Red 373H-Pyrazol-3-one, 4,4-(3,3-dimethoxy1,1-biphenyl-4,4-diyl)bis(azo)bis2,4-dihydro-5-methyl-2-(4-methylphenyl)-
이름 더 보기
4,4'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[2,4-dihydro-5-methyl-2-(p-tolyl)-3H-pyrazol-3-one]4,4'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl) bis (azo)] bis[2,4-dihydro-5-methyl-2-(4-methyl3H-Pyrazol-3-one4,4'-[(3,3'-Dimethoxy-1,1'-biphenyl-4,4'-diyl)bis(azo)]bis[2,4-dihydro-5-methyl-2-(4-methylphenyl)-3H-pyrazol-3-one]3H-Pyrazol-3-one, 4,4'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(2,1-diazenediyl)]bis[2,4-dihydro-5-methyl-2-(4-methylphenyl)-
물성
구조 계산 물성
- XLogP
- 8.5
- 극성 표면적
- 144 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 48
- 형식 전하
- 0
- 복잡도
- 987
물리화학적 성질
- 끓는 점
- 855.3 · 855.3±65.0 °C(Predicted)
- 밀도
- 1.3 · 1.30±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 1.62 · 1.62±0.70(Predicted)
- EPA
- 3 H-Pyrazol-3-one, · 3H-Pyrazol-3-one, 4,4'-[(3,3'-dimethoxy[1,1'-biphenyl]-4,4'-diyl)bis(azo)]bis[2,4-dihydro-5-methyl-2-(4-methylphenyl)- (6883-91-6)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- tsca
- TSCA listed
관련 반응
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