methyl (Z)-[4-[3-(4-iodophenyl)-3-(2-methylbenzo[b]furan-5-yl)allyloxy]-2-methylphenoxy]acetate

HCID 86629296

기본 정보

표준 SMILES
COC(=O)COc1ccc(OC/C=C(/c2ccc(I)cc2)c2ccc3oc(C)cc3c2)cc1C
InChIKey
BICTVNXJEQVRED-ROTLSHHCSA-N
분자식
C28H25IO5
평균 분자량
568.4 g/mol

이름 및 식별자

우선 이름
methyl (Z)-[4-[3-(4-iodophenyl)-3-(2-methylbenzo[b]furan-5-yl)allyloxy]-2-methylphenoxy]acetate
IUPAC
methyl 2-[4-[(Z)-3-(4-iodophenyl)-3-(2-methyl-1-benzofuran-5-yl)prop-2-enoxy]-2-methylphenoxy]acetate

이름 및 동의어

BICTVNXJEQVRED-ROTLSHHCSA-Nmethyl (Z)-[4-[3-(4-iodophenyl)-3-(2-methyl-benzo[b]furan-5-yl)allyloxy]-2-methylphenoxy]acetatemethyl (Z)-[4-[3-(4-iodophenyl)-3-(2-methylbenzo[b]-furan-5-yl)allyloxy]-2-methylphenoxy]acetatemethyl (Z)-[4-[3-(4-iodophenyl)-3-(2-methylbenzo[b]furan-5-yl)allyloxy]-2-methylphenoxy]acetate

데이터베이스 식별자

PubChem CID
86629296

물성

구조 계산 물성

XLogP
7.6
극성 표면적
57.9 Ų
수소 결합 공여자 수
0
수소 결합 수용자 수
5
회전 가능 결합 수
9
무거운 원자 수
34

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