기본 정보
- CAS
113969-08-7- 표준 SMILES
CCN(CCOc1nc(F)nc(NCCOC)n1)c1ccc(N=Nc2sc(N=Nc3ccccc3)cc2C#N)cc1- InChIKey
VJRVKJQSLFOEEI-UHFFFAOYSA-N- 분자식
- C27H27FN10O2S
- 평균 분자량
- 574.6 g/mol
- 단동위원소 질량
- 574.20231948
이름 및 식별자
- 우선 이름
- 3-Thiophenecarbonitrile, 2-[[4-[ethyl[2-[[4-fluoro-6-[(2-methoxyethyl)amino]-1,3,5-triazin-2-yl]oxy]ethyl]amino]phenyl]azo]-5-(phenylazo)-
- IUPAC
- 2-[[4-[ethyl-[2-[[4-fluoro-6-(2-methoxyethylamino)-1,3,5-triazin-2-yl]oxy]ethyl]amino]phenyl]diazenyl]-5-phenyldiazenylthiophene-3-carbonitrile
- 영어명
- 2-[[4-[Ethyl[2-[[4-fluoro-6-[(2-methoxyethyl)amino]-s-triazine-2-yl]oxy]ethyl]amino]phenyl]azo]-5-(phenylazo)thiophene-3-carbonitrile
- 분자식
- C27H27FN10O2S
- 분자량
- 574.63
이름 및 동의어
113969-08-73-Thiophenecarbonitrile, 2-((4-(ethyl(2-((4-fluoro-6-((2-methoxyethyl)amino)-1,3,5-triazin-2-yl)oxy)ethyl)amino)phenyl)azo)-5-(phenylazo)-3-Thiophenecarbonitrile, 2-[[4-[ethyl[2-[[4-fluoro-6-[(2-methoxyethyl)amino]-1,3,5-triazin-2-yl]oxy]ethyl]amino]phenyl]azo]-5-(phenylazo)-RefChem:505461VJRVKJQSLFOEEI-UHFFFAOYSA-N2-[4-[N-Ethyl-2-[4-fluoro-6-(2-methoxyethylamino)-1,3,5-triazine-2-yloxy]ethylamino]phenylazo]-5-phenylazo-3-thiophenecarbonitrile2-[[4-[Ethyl[2-[[4-fluoro-6-[(2-methoxyethyl)amino]-s-triazine-2-yl]oxy]ethyl]amino]phenyl]azo]-5-(phenylazo)thiophene-3-carbonitrile2-[4-[N-Ethyl-N-[2-[4-fluoro-6-(2-methoxyethylamino)-1,3,5-triazin-2-yloxy]ethyl]amino]phenylazo]-5-phenylazo-3-thiophenecarbonitrile3-Thiophenecarbonitrile, 2-[2-[4-[ethyl[2-[[4-fluoro-6-[(2-methoxyethyl)amino]-1,3,5-triazin-2-yl]oxy]ethyl]amino]phenyl]diazenyl]-5-(2-phenyldiazenyl)-
데이터베이스 식별자
- CAS
113969-08-7
물성
구조 계산 물성
- XLogP
- 6.7
- 극성 표면적
- 174 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 14
- 회전 가능 결합 수
- 14
- 무거운 원자 수
- 41
- 형식 전하
- 0
- 복잡도
- 864
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
유해성 정보
Regulatory InformationChemical: 3-Thiophenecarbonitrile, 2-[[4-[ethyl[2-[[4-fluoro-6-[(2-methoxyethyl)amino]-1,3,5-triazin-2-yl]oxy]ethyl]amino]phenyl]azo]-5-(phenylazo)-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
화학 및 산업
공급사1 곳
济南思考化学有限公司0531-0000 · [email protected]
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