Quinolinium, 1-ethyl-2-[3-(1-ethyl-2(1H)-quinolinylidene)-1-propen-1-yl]-, 4-methylbenzenesulfonate (1:1)
기본 정보
- CAS
14124-47-1- 표준 SMILES
CCN1/C(=C/C=C/c2ccc3ccccc3[n+]2CC)C=Cc2ccccc21.Cc1ccc(S(=O)(=O)[O-])cc1- InChIKey
SYEMVGWVIYBZSM-UHFFFAOYSA-M- 분자식
- C32H32N2O3S
- 평균 분자량
- 524.7 g/mol
- 단동위원소 질량
- 524.21336406
이름 및 식별자
- 우선 이름
- Quinolinium, 1-ethyl-2-[3-(1-ethyl-2(1H)-quinolinylidene)-1-propen-1-yl]-, 4-methylbenzenesulfonate (1:1)
- IUPAC
- (2E)-1-ethyl-2-[(E)-3-(1-ethylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline;4-methylbenzenesulfonate
이름 및 동의어
14124-47-1Quinolinium, 1-ethyl-2-(3-(1-ethyl-2(1H)-quinolinylidene)-1-propenyl)-, salt with 4-methylbenzenesulfonic acid (1:1)DTXSID6065711Quinolinium, 1-ethyl-2-(3-(1-ethyl-2(1H)-quinolinylidene)-1-propen-1-yl)-, 4-methylbenzenesulfonate (1:1)Quinolinium, 1-ethyl-2-[3-(1-ethyl-2(1H)-quinolinylidene)-1-propenyl]-, salt with 4-methylbenzenesulfonic acid (1:1)Quinolinium, 1-ethyl-2-[3-(1-ethyl-2(1H)-quinolinylidene)-1-propen-1-yl]-, 4-methylbenzenesulfonate (1:1)RefChem:178284DTXCID30345851-ethyl-2-[(1E)-3-[(2E)-1-ethyl-1,2-dihydroquinolin-2-ylidene]prop-1-en-1-yl]quinolin-1-ium 4-methylbenzene-1-sulfonateAKOS015958897EN300-21859316F9995-0076
이름 더 보기
(2E)-1-ethyl-2-[(E)-3-(1-ethylquinolin-1-ium-2-yl)prop-2-enylidene]quinoline;4-methylbenzenesulfonate1-ethyl-2-((1E,3E)-3-(1-ethylquinolin-2(1H)-ylidene)prop-1-en-1-yl)quinolin-1-ium 4-methylbenzenesulfonate
데이터베이스 식별자
- CAS
물성
구조 계산 물성
- 극성 표면적
- 72.7 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 4
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 720
화학 및 산업
용도 및 제조
General Manufacturing InformationQuinolinium, 1-ethyl-2-[3-(1-ethyl-2(1H)-quinolinylidene)-1-propen-1-yl]-, 4-methylbenzenesulfonate (1:1): INACTIVE
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