기본 정보
- CAS
20970-67-6- 표준 SMILES
CC(=O)C1=C(C)NC(C)=C(C(C)=O)C1c1ccccc1- InChIKey
GAJJRTVBAXALLD-UHFFFAOYSA-N- 분자식
- C17H19NO2
- 평균 분자량
- 269.34 g/mol
- 단동위원소 질량
- 269.14157885
이름 및 식별자
- 우선 이름
- 2,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-
- IUPAC
- 1-(5-acetyl-2,6-dimethyl-4-phenyl-1,4-dihydropyridin-3-yl)ethanone
- 영어명
- NSC 150004
- 분자식
- C17H19NO2
- 분자량
- 269.34
이름 및 동의어
20970-67-62,6-Lutidine, 3,5-diacetyl-1,4-dihydro-4-phenyl-2,6-Dimethyl-3,5-diacetyl-4-phenyl-1,4-dihydropyridine4-Phenyl-2,6-dimethyl-3,5-diacetyl-1,4-dihydropyridineKXI8OO36XPNSC-1500043,5-diacetyl-2,6-dimethyl-4-phenyl-1,4-dihydropyridineEthanone, 1,1'-(1,4-dihydro-2,6-dimethyl-4-phenyl-3,5-pyridinediyl)bis-1-(5-Acetyl-2,6-dimethyl-4-phenyl-1,4-dihydro-pyridin-3-yl)-ethanoneEthanone, 1,1'-(1,4,-dihydro-2,6-dimethyl-4-phenyl-3,5-pyridinediyl)bis-NSC150004UNII-KXI8OO36XP
이름 더 보기
NSC 1500043,5-Diacetyl-1,4-dihydro-4-phenyl-2,6-lutidine3,5-Diacetyl-4-phenyl-2,6-dimethyl-1,4-dihydropyridine1,1'-(2,6-Dimethyl-4-phenyl-1,4-dihydropyridine-3,5-diyl)bisethanone1,1'-(1,4-Dihydro-2,6-dimethyl-4-phenyl-3,5-pyridinediyl)bis(ethanone)
1-(5-acetyl-2,6-dimethyl-4-phenyl-1,4-dihydropyridin-3-yl)ethanoneMLS000689220SCHEMBL7817490CHEMBL1335931DTXSID90175150GAJJRTVBAXALLD-UHFFFAOYSA-NHMS2711J103,5-DIACETYL-1,4-DIHYDRO-2,6-DIMETHYL-4-PHENYLPYRIDINE
데이터베이스 식별자
- CAS
20970-67-6- PubChem CID
- 88738
- DTXSID
DTXSID90175150- ChEMBL
CHEMBL1335931- UNII
- KXI8OO36XP
- Nikkaji
- J142.432G
물성
구조 계산 물성
- XLogP
- 2.2
- 극성 표면적
- 46.2 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 3
- 회전 가능 결합 수
- 3
- 무거운 원자 수
- 20
- 형식 전하
- 0
- 복잡도
- 457
실험 및 물리화학적 성질
SpringerMaterials Properties15N nuclear magnetic resonance spectrum
Solubility35.3 [ug/mL] (The mean of the results at pH 7.4)
화학 및 산업
공급사2 곳
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
江苏新素新材料有限公司0512-66387919 15251950002 · [email protected]
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