기본 정보
- CAS
397875-10-4- 표준 SMILES
CCOC(=O)C1=C(C)NC2=C(C(=O)CC(C)(C)C2)C1c1ccc(OCc2cccc(Cl)c2)c(OC)c1- InChIKey
ILWJCJRFISEYSK-UHFFFAOYSA-N- 분자식
- C29H32ClNO5
- 평균 분자량
- 510 g/mol
이름 및 식별자
- 우선 이름
- Ethyl 4-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
- IUPAC
- ethyl 4-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate
- 영어명
- ethyl 4-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
- 분자식
- C29H32ClNO5
- 분자량
- 510.02108
이름 및 동의어
ethyl 4-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate397875-10-4Oprea1_258528AK-968/15342062STL173069AKOS003264764ethyl 4-[4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylateST028593ethyl 4-{4-[(3-chlorobenzyl)oxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylateethyl 4-{4-[(3-chlorophenyl)methoxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1, 4,6,7,8-pentahydroquinoline-3-carboxylate
데이터베이스 식별자
- CAS
397875-10-4
물성
구조 계산 물성
- XLogP
- 5.7
- 극성 표면적
- 73.9 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 8
- 무거운 원자 수
- 36
- 형식 전하
- 0
- 복잡도
- 909
화학 및 산업
공급사1 곳
SPECS[email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…