기본 정보
- CAS
68911-99-9- 표준 SMILES
CCN(CC)c1ccc(C(=C2C=CC(=[N+](CC)CC)C=C2)c2ccc(N(C)C)cc2Cl)cc1.[I-]- InChIKey
QTRZAQYNXUXERX-UHFFFAOYSA-M- 분자식
- C29H37ClIN3
- 평균 분자량
- 590 g/mol
- 단동위원소 질량
- 589.17207
이름 및 식별자
- 우선 이름
- Ethanaminium, N-[4-[[2-chloro-4-(dimethylamino)phenyl][4-(diethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-, iodide (1:1)
- IUPAC
- [4-[[2-chloro-4-(dimethylamino)phenyl]-[4-(diethylamino)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-diethylazanium iodide
이름 및 동의어
68911-99-9DTXSID30887563Ethanaminium, N-(4-((2-chloro-4-(dimethylamino)phenyl)(4-(diethylamino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-, iodideEthanaminium, N-(4-((2-chloro-4-(dimethylamino)phenyl)(4-(diethylamino)phenyl)methylene)-2,5-cyclohexadien-1-ylidene)-N-ethyl-, iodide (1:1)Ethanaminium, N-[4-[[2-chloro-4-(dimethylamino)phenyl][4-(diethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-, iodideEthanaminium, N-[4-[[2-chloro-4-(dimethylamino)phenyl][4-(diethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-, iodide (1:1)RefChem:138108DTXCID201026853QTRZAQYNXUXERX-UHFFFAOYSA-M4-{[2-Chloro-4-(dimethylamino)phenyl][4-(diethylamino)phenyl]methylidene}-N,N-diethylcyclohexa-2,5-dien-1-iminium iodide
데이터베이스 식별자
- CAS
68911-99-9- PubChem CID
- 111745
- DTXSID
DTXSID30887563
물성
구조 계산 물성
- 극성 표면적
- 9.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 684
화학 및 산업
용도 및 제조
General Manufacturing InformationEthanaminium, N-[4-[[2-chloro-4-(dimethylamino)phenyl][4-(diethylamino)phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-, iodide (1:1): INACTIVE
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…