Chem
J-GLOBAL ID：201807007191759707
Nikkaji number：J3.729.750J
ビス[3-[3-オキソ-3-(ヘキシルオキシ)-1-プロペニル]-5-(2-ヒドロキシエトキシ)フェニル]エチン
ビス[3-[3-オキソ-3-(ヘキシルオキシ)-1-プロペニル]-5-(2-ヒドロキシエトキシ)フェニル]エチン
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C36H46O8
Molecular formula furigana： C36-H46-O8
Molecular weight： 606.756
InChI：
InChI=1S/C36H46O8/c1-3-5-7-9-19-43-35(39)15-13-31-23-29(25-33(27-31)41-21-17-37)11-12-30-24-32(28-34(26-30)42-22-18-38)14-16-36(40)44-20-10-8-6-4-2/h13-16,23-28,37-38H,3-10,17-22H2,1-2H3
InChI key：
PINKKCZJGDKINX-UHFFFAOYSA-N
SMILES：
C(#Cc1cc(cc(c1)OCCO)C=CC(=O)OCCCCCC)c1cc(cc(c1)OCCO)C=CC(=O)OCCCCCC
Systematic name (3)：
- ビス[3-[3-オキソ-3-(ヘキシルオキシ)-1-プロペニル]-5-(2-ヒドロキシエトキシ)フェニル]エチン
- ヘキシル3-[3-(2-{3-[3-(ヘキシルオキシ)-3-オキソプロパ-1-エン-1-イル]-5-(2-ヒドロキシエトキシ)フェニル}エチニル)-5-(2-ヒドロキシエトキシ)フェニル]プロパ-2-エノアート
- hexyl 3-[3-(2-{3-[3-(hexyloxy)-3-oxoprop-1-en-1-yl]-5-(2-hydroxyethoxy)phenyl}ethynyl)-5-(2-hydroxyethoxy)phenyl]prop-2-enoate
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