기본 정보
- CAS
72939-67-4- 표준 SMILES
Cc1c(C#N)c(NCCCOCCCCO)nc(N)c1N=Nc1ccc([N+](=O)[O-])cc1Cl- InChIKey
VFCJEFOSAGTGOU-UHFFFAOYSA-N- 분자식
- C20H24ClN7O4
- 평균 분자량
- 461.9 g/mol
- 단동위원소 질량
- 461.15783
이름 및 식별자
- 우선 이름
- 3-Pyridinecarbonitrile, 6-amino-5-(2-(2-chloro-4-nitrophenyl)diazenyl)-2-((3-(4-hydroxybutoxy)propyl)amino)-4-methyl-
- IUPAC
- 6-amino-5-[(2-chloro-4-nitrophenyl)diazenyl]-2-[3-(4-hydroxybutoxy)propylamino]-4-methylpyridine-3-carbonitrile
- 영어명
- 6-amino-5-[(2-chloro-4-nitrophenyl)azo]-2-[[3-(4-hydroxybutoxy)propyl]amino]-4-methylnicotinonitrile
- 분자식
- C20H24ClN7O4
- 분자량
- 461.9
이름 및 동의어
EINECS 277-113-93-Pyridinecarbonitrile, 6-amino-5-[(2-chloro-4-nitrophenyl)azo]-2-[[3-(4-hydroxybutoxy)propyl]amino]-4-methyl-3-Pyridinecarbonitrile, 6-amino-5-((2-chloro-4-nitrophenyl)azo)-2-((3-(4-hydroxybutoxy)propyl)amino)-4-methyl-3-Pyridinecarbonitrile, 6-amino-5-(2-(2-chloro-4-nitrophenyl)diazenyl)-2-((3-(4-hydroxybutoxy)propyl)amino)-4-methyl-3-Pyridinecarbonitrile, 6-amino-5-[2-(2-chloro-4-nitrophenyl)diazenyl]-2-[[3-(4-hydroxybutoxy)propyl]amino]-4-methyl-RefChem:50516272939-67-46-AMINO-5-[(2-CHLORO-4-NITROPHENYL)AZO]-2-[[3-(4-HYDROXYBUTOXY)PROPYL]AMINO]-4-METHYLNICOTINONITRILE6-Amino-5-((2-chloro-4-nitrophenyl)azo)-2-((3-(4-hydroxybutoxy)propyl)amino)-4-methylnicotinonitrile5LZR6K2W48DTXSID6072681VFCJEFOSAGTGOU-UHFFFAOYSA-N
이름 더 보기
6-Amino-5-(2-chloro-4-nitrophenylazo)-4-methyl-2-[3-(4-hydroxybutoxy)propylamino]pyridine-3-carbonitrile
NS000374446-Amino-5-[(2-chloro-4-nitrophenyl)diazenyl]-2-{[3-(4-hydroxybutoxy)propyl]amino}-4-methylpyridine-3-carbonitrile6-Amino-5-[2-(2-chloro-4-nitrophenyl)diazenyl]-2-[[3-(4-hydroxybutoxy)propyl]amino]-4-methyl-3-pyridinecarbonitrile
물성
구조 계산 물성
- XLogP
- 3.9
- 극성 표면적
- 175 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 656
물리화학적 성질
- 끓는 점
- 739.965 · 739.965±60.00 °C(Press: 760.00 Torr)(predicted)
- 밀도
- 1.412 · 1.412±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- 산도 계수 (pKa)
- 15.072 · 15.072±0.10(predicted)
- EPA
- 3 · 3-Pyridinecarbonitrile, 6-amino-5-[(2-chloro-4-nitrophenyl)azo]-2-[[3-(4-hydroxybutoxy)propyl]amino]-4-methyl- (72939-67-4)
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
안전 데이터
- tsca
- TSCA listed
화학 및 산업
용도 및 제조
General Manufacturing Information3-Pyridinecarbonitrile, 6-amino-5-[2-(2-chloro-4-nitrophenyl)diazenyl]-2-[[3-(4-hydroxybutoxy)propyl]amino]-4-methyl-: INACTIVE
공급사1 곳
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
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