기본 정보
- CAS
154185-82-7- 표준 SMILES
COc1ccc(-c2cc(=O)c3cc(C4=NN(C=O)C(c5ccc(OC)c(OC)c5)C4)ccc3o2)cc1OC- InChIKey
JSHRBVHKJFJSMK-UHFFFAOYSA-N- 분자식
- C29H26N2O7
- 평균 분자량
- 514.5 g/mol
- 단동위원소 질량
- 514.17400117
이름 및 식별자
- 우선 이름
- 1H-Pyrazole-1-carboxaldehyde, 4,5-dihydro-5-(3,4-dimethoxyphenyl)-3-(2-(3,4-dimethoxyphenyl)-4-oxo-4H-1-benzopyran-6-yl)-
- IUPAC
- 3-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)-4-oxochromen-6-yl]-3,4-dihydropyrazole-2-carbaldehyde
- 영어명
- 1H-Pyrazole-1-carboxaldehyde, 4,5-dihydro-5-(3,4-dimethoxyphenyl)-3-(2 -(3,4-dimethoxyphenyl)-4-oxo-4H-1-benzopyran-6-yl)-
- 분자식
- C29H26N2O7
- 분자량
- 514.53
이름 및 동의어
154185-82-71H-Pyrazole-1-carboxaldehyde, 4,5-dihydro-5-(3,4-dimethoxyphenyl)-3-(2-(3,4-dimethoxyphenyl)-4-oxo-4H-1-benzopyran-6-yl)-RefChem:2398603-(3,4-dimethoxyphenyl)-5-[2-(3,4-dimethoxyphenyl)-4-oxochromen-6-yl]-3,4-dihydropyrazole-2-carbaldehydeDTXSID109349435-(3,4-Dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-oxo-4H-1-benzopyran-6-yl]-4,5-dihydro-1H-pyrazole-1-carbaldehyde1H-Pyrazole-1-carboxaldehyde, 5-(3,4-dimethoxyphenyl)-3-[2-(3,4-dimethoxyphenyl)-4-oxo-4H-1-benzopyran-6-yl]-4,5-dihydro-1H-Pyrazole-1-carboxaldehyde, 4,5-dihydro-5-(3,4-dimethoxyphenyl)-3-(2 -(3,4-dimethoxyphenyl)-4-oxo-4H-1-benzopyran-6-yl)-
데이터베이스 식별자
- CAS
154185-82-7- PubChem CID
- 3073979
- DTXSID
DTXSID10934943
물성
구조 계산 물성
- XLogP
- 3.9
- 극성 표면적
- 95.9 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 8
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 38
- 형식 전하
- 0
- 복잡도
- 923
화학 및 산업
공급사1 곳
HONEST JOY HOLDINGS LIMITED[email protected]
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