1-(tert-Butyl) 3-ethyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1,3(2H)-dicarboxylate

HCID 22228409

기본 정보

표준 SMILES
CCOC(=O)C1=C(OS(=O)(=O)C(F)(F)F)CCN(C(=O)OC(C)(C)C)C1
InChIKey
QBSFHOMPPMKXAV-UHFFFAOYSA-N
분자식
C14H20F3NO7S
평균 분자량
403.37 g/mol

이름 및 식별자

우선 이름
1-(tert-Butyl) 3-ethyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1,3(2H)-dicarboxylate
IUPAC
1-O-tert-butyl 5-O-ethyl 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1,5-dicarboxylate

이름 및 동의어

176525-98-71-(tert-Butyl) 3-ethyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1,3(2H)-dicarboxylateMFCD209220481,3(2H)-Pyridinedicarboxylic acid, 5,6-dihydro-4-[[(trifluoromethyl)sulfonyl]oxy]-, 1-(1,1-dimethylethyl) 3-ethyl ester1-O-tert-butyl 5-O-ethyl 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1,5-dicarboxylate1-tert-butyl 3-ethyl 4-(((trifluoromethyl)sulfonyl)oxy)-5,6-dihydropyridine-1,3(2H)-dicarboxylate4-Trifluoromethanesulfonyloxy-5,6-dihydro-2H-pyridine-1,3-dicarboxylic Acid 1-tert-butyl Ester 3-ethyl Ester1-tert-butyl 3-ethyl 4-{[(trifluoromethyl)sulfonyl]oxy}-5,6-dihydropyridine-1,3(2H)-dicarboxylateSCHEMBL556981C14H20F3NO7S1-tert-butyl 3-ethyl 4-(trifluoromethanesulfonyloxy)-1,2,5,6-tetrahydropyridine-1,3-dicarboxylateCS-0100171
이름 더 보기
G81170A1-017251-(1,1-dimethylethyl) 3-ethyl 4-{[(trifluoromethyl)sulfonyl]oxy}-5,6-dihydro-1,3(2H)-pyridinedicarboxylate1-tert-butyl 3-ethyl 4-{[(trifluoromethyl)-sulfonyl]oxy}-5,6-dihydropyridine-1,3(2H)-dicarboxylate1-tert-Butyl 3-ethyl 4-{[(trifluoromethyl)sulfonyl]oxy}-5,6-dihydropyridin-1,3(2H)-dicarboxylateO1-tert-butyl O5-ethyl 4-(trifluoromethylsulfonyloxy)-3,6-dihydro-2H-pyridine-1,5-dicarboxylate

데이터베이스 식별자

PubChem CID
22228409
Nikkaji
J3.509.858E

물성

구조 계산 물성

XLogP
2.2
극성 표면적
108 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
10
회전 가능 결합 수
7
무거운 원자 수
26

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