기본 정보
- CAS
92569-97-6- 표준 SMILES
CC(=CC=C1N(C)c2ccccc2C1(C)C)C1=CC(=C(C)C=CC2=[N+](C)c3ccccc3C2(C)C)CC(C)(C)C1.[O-][Cl+3]([O-])([O-])[O-]- InChIKey
GHRZFFMTTAJQCR-UHFFFAOYSA-M- 분자식
- C38H47ClN2O4
- 평균 분자량
- 631.2 g/mol
- 단동위원소 질량
- 630.3224357
이름 및 식별자
- 우선 이름
- 2-(3-{5,5-Dimethyl-3-[4-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)but-2-en-2-yl]cyclohex-2-en-1-ylidene}but-1-en-1-yl)-1,3,3-trimethyl-3H-indol-1-ium perchlorate
- IUPAC
- 2-[3-[5,5-dimethyl-3-[4-(1,3,3-trimethylindol-1-ium-2-yl)but-3-en-2-ylidene]cyclohexen-1-yl]but-2-enylidene]-1,3,3-trimethylindole perchlorate
- 영어명
- 2-((E)-3-(5,5-Dimethyl-3-[(E)-1-methyl-3-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1-propenyl]-2-cyclohexen-1-ylidene)-1-butenyl)-1,3,3-trimethyl-3H-indolium perchlorate
- 분자식
- C38H47ClN2O4
- 분자량
- 631.24
이름 및 동의어
92569-97-62-(3-{5,5-Dimethyl-3-[4-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)but-2-en-2-yl]cyclohex-2-en-1-ylidene}but-1-en-1-yl)-1,3,3-trimethyl-3H-indol-1-ium perchlorateDTXSID508493452-[3-[5,5-dimethyl-3-[4-(1,3,3-trimethylindol-1-ium-2-yl)but-3-en-2-ylidene]cyclohexen-1-yl]but-2-enylidene]-1,3,3-trimethylindole;perchlorate3H-INDOLIUM, 2-[3-[3-[3-(1,3-DIHYDRO-1,3,3-TRIMETHYL-2H-INDOL-2-YLIDENE)-1-METHYL-1-PROPENYL]-5,5-DIMETHYL-2-CYCLOHEXEN-1-YLIDENE]-1-BUTENYL]-1,3,3-TRIMETHYL-, PERCHLORATE2-((E)-3-(5,5-Dimethyl-3-[(E)-1-methyl-3-(1,3,3-trimethyl-1,3-dihydro-2H-indol-2-ylidene)-1-propenyl]-2-cyclohexen-1-ylidene)-1-butenyl)-1,3,3-trimethyl-3H-indolium perchlorate2-((e)-3-(5,5-dimethyl-3-((e)-1-methyl-3-(1,3,3-trimethyl-1,3-dihydro-2h-indol-2-ylidene)-1-propenyl)-2-cyclohexen-1-ylidene)-1-butenyl)-1,3,3-trimethyl-3h-indolium perchlorate
데이터베이스 식별자
- CAS
92569-97-6
물성
구조 계산 물성
- 극성 표면적
- 80.5 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 45
- 형식 전하
- 0
- 복잡도
- 1,200
화학 및 산업
공급사1 곳
重庆卡兰医药有限公司[email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…