기본 정보
- CAS
478067-23-1- 표준 SMILES
CCOC(=O)c1nn(-c2ccc(C(F)(F)F)cc2)c(=O)cc1C(F)(F)F- InChIKey
ASBYHIWLJPNHSR-UHFFFAOYSA-N- 분자식
- C15H10F6N2O3
- 평균 분자량
- 380.24 g/mol
- 단동위원소 질량
- 380.05956116
이름 및 식별자
- 우선 이름
- Ethyl 6-oxo-4-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-1,6-dihydro-3-pyridazinecarboxylate
- IUPAC
- ethyl 6-oxo-4-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyridazine-3-carboxylate
- 영어명
- ETHYL 6-OXO-4-(TRIFLUOROMETHYL)-1-[4-(TRIFLUOROMETHYL)PHENYL]-1,6-DIHYDRO-3-PYRIDAZINECARBOXYLATE
- 분자식
- C15H10F6N2O3
- 분자량
- 380.24
이름 및 동의어
478067-23-1ethyl 6-oxo-4-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-1,6-dihydro-3-pyridazinecarboxylateMFCD02082934ethyl 6-oxo-4-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-1,6-dihydropyridazine-3-carboxylateethyl 6-oxo-4-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]pyridazine-3-carboxylateEthyl 6-oxo-4-(trifluoromethyl)-1-(4-(trifluoromethyl)phenyl)-1,6-dihydropyridazine-3-carboxylateBionet1_003800HMS579J22AKOS0051011167M-631Sethyl6-oxo-4-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-1,6-dihydropyridazine-3-carboxylate3-Pyridazinecarboxylic acid, 1,6-dihydro-6-oxo-4-(trifluoromethyl)-1-[4-(trifluoromethyl)phenyl]-, ethyl ester
데이터베이스 식별자
- CAS
478067-23-1- PubChem CID
- 1484466
물성
구조 계산 물성
- XLogP
- 3.4
- 극성 표면적
- 59 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 10
- 회전 가능 결합 수
- 4
- 무거운 원자 수
- 26
- 형식 전하
- 0
- 복잡도
- 630
물리화학적 성질
- 끓는 점
- 357.2 · 357.2±52.0 °C(Predicted)
- 밀도
- 1.45 · 1.45±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- -4.82 · -4.82±0.60(Predicted)
화학 및 산업
공급사3 곳
Ryan Scientific, Inc.[email protected]
Key Organics Ltd.[email protected]
BIONET-INTER[email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…