ethyl 2-[(1R)-1-(2-tert-butoxy-2-oxoethyl)-4-cyclohexylbutyl]-1,3-oxazole-4-carboxylate

HCID 59110691

기본 정보

표준 SMILES
CCOC(=O)c1coc([C@H](CCCC2CCCCC2)CC(=O)OC(C)(C)C)n1
InChIKey
BKBAQHIHGCAHQN-QGZVFWFLSA-N
분자식
C22H35NO5
평균 분자량
393.5 g/mol

이름 및 식별자

우선 이름
ethyl 2-[(1R)-1-(2-tert-butoxy-2-oxoethyl)-4-cyclohexylbutyl]-1,3-oxazole-4-carboxylate
IUPAC
ethyl 2-[(3R)-6-cyclohexyl-1-[(2-methylpropan-2-yl)oxy]-1-oxohexan-3-yl]-1,3-oxazole-4-carboxylate

이름 및 동의어

SCHEMBL5408426BKBAQHIHGCAHQN-QGZVFWFLSA-Nethyl 2-[(1R)-1-(2-tert-butoxy-2-oxoethyl)-4-cyclohexylbutyl]-1,3-oxazole-4-carboxylateethyl 2-{(1R)-1 -[2-(tert-butoxy)-2-oxoethyl]-4-cyclohexylbutyl}-1,3-oxazole-4-carboxylateEthyl 2-{(1R)-1-[2-(tert-butoxy)-2-oxoethyl]-4-cyclohexylbutyl}-1,3-oxazole-4-carboxylate

데이터베이스 식별자

PubChem CID
59110691

물성

구조 계산 물성

XLogP
6
극성 표면적
78.6 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
6
회전 가능 결합 수
12
무거운 원자 수
28

관련 반응

6건

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