Ethyl 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate
기본 정보
- CAS
294854-98-1- 표준 SMILES
CCOC(=O)COc1ccc2c(=O)c(-c3ccc4c(c3)OCCO4)c(C(F)(F)F)oc2c1- InChIKey
CGCXHWODOMRAET-UHFFFAOYSA-N- 분자식
- C22H17F3O7
- 평균 분자량
- 450.4 g/mol
이름 및 식별자
- 우선 이름
- Ethyl 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate
- IUPAC
- ethyl 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetate
- 영어명
- ethyl {[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}acetate
- 분자식
- C22H17F3O7
- 분자량
- 450.36
이름 및 동의어
ethyl {[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl]oxy}acetateChemDiv1_000933HMS589K09EiM07-28846AKOS000574472ethyl 2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetateAF-399/36407056294854-98-1ethyl 2-((3-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl)oxy)acetateETHYL 2-{[3-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-4-OXO-2-(TRIFLUOROMETHYL)-4H-CHROMEN-7-YL]OXY}ACETATEAcetic acid, 2-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl]oxy]-, ethyl ester
데이터베이스 식별자
- CAS
294854-98-1
물성
구조 계산 물성
- XLogP
- 4
- 극성 표면적
- 80.3 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 6
- 무거운 원자 수
- 32
- 형식 전하
- 0
- 복잡도
- 750
관련 반응
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