기본 정보
- CAS
1330173-18-6- 표준 SMILES
COc1ccc(CCN(C)CCC(C#N)(c2ccc(OC)c(OC)c2)C(C)C)cc1OC.Cl- InChIKey
FVLOHGQKBZSXNK-UHFFFAOYSA-N- 분자식
- C26H37ClN2O4
- 평균 분자량
- 477 g/mol
이름 및 식별자
- 우선 이름
- D-517 hydrochloride
- IUPAC
- 2-(3,4-dimethoxyphenyl)-2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]-3-methylbutanenitrile;hydrochloride
- 영어명
- D 517-d7 Hydrochloride (VerapaMil IMpurity)
- 분자식
- C26H37ClN2O4
- 분자량
- 477.03598
이름 및 동의어
1794-55-4D-517 hydrochlorideD-517 hydrochloride, (RS)-UNII-3VK59M207R3VK59M207Ralpha-(2-((2-(3,4-Dimethoxyphenyl)-ethyl)methylamino)ethyl)-3,4-dimethoxy-alpha-(1-methylethyl)-benzeneacetonitrile monohydrochlorideBenzeneacetonitrile, alpha-(2-((2-(3,4-dimethoxyphenyl)ethyl)methylamino)ethyl)-3,4-dimethoxy-alpha-(1-methylethyl)-, hydrochloride (1:1)BENZENEACETONITRILE, .ALPHA.-(2-((2-(3,4-DIMETHOXYPHENYL)ETHYL)METHYLAMINO)ETHYL)-3,4-DIMETHOXY-.ALPHA.-(1-METHYLETHYL)-, HYDROCHLORIDE (1:1)RefChem:200323D 517 Hydrochloride (Verapamil Impurity)2-(3,4-dimethoxyphenyl)-2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]-3-methylbutanenitrile;hydrochloride4-((3,4-Dimethoxyphenethyl)(methyl)amino)-2-(3,4-dimethoxyphenyl)-2-isopropylbutanenitrile hydrochloride
이름 더 보기
Zeatin Impurity 22D 517-d7 Hydrochloride (VerapaMil IMpurity)4-[(3,4-DiMethoxyphenethyl)MethylaMino]- 2-(3,4-diMethoxyphenyl)-2-(isopropyl-d7)butyroα-[2-[[2-(3,4-DiMethoxyphenyl)ethyl]MethylaMino]ethyl]-3,4-diMethoxy-α-(1-Methylethyl-d7)benzeneacetonitrile Hydrochloride3,4,4,4-tetradeuterio-2-(3,4-dimethoxyphenyl)-2-[2-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]ethyl]-3-(trideuteriomethyl)butanenitrile
(2RS)-2-(3,4-Dimethoxyphenyl)-2-[2-[[2-(3,4-dimethoxy-phenyl)ethyl](methyl)amino]ethyl]-3-methyl-butanenitrile HydrochlorideVerapamil impurity I CRSVerapamil EP Impurity I(HCl)FVLOHGQKBZSXNK-UHFFFAOYSA-NVerapamil i mpurity I hydrochlorideID20771Q27258091?-[2-[[2-(3,4-dimethoxyphenyl)ethyl]methylamino]ethyl]-3,4-dimethoxy-?-(1-methylethyl)-benzeneacetonitrile hydrochloride
데이터베이스 식별자
- CAS
1330173-18-6- UNII
- 3VK59M207R
- EC Number
- 641-561-7
물성
구조 계산 물성
- 극성 표면적
- 64 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 592
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
화학 및 산업
응용 분야
용도Labelled Verapamil (V125000) impurity.
공급사4 곳
凯试(上海)科技有限公司021-50135380 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
湖北扬信医药科技有限公司07143299675 13092790750 · [email protected]
南京世洲生物科技有限公司17301488900 · [email protected]
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