Chem
J-GLOBAL ID：201507017211500938
Nikkaji number：J3.453.234F
5-Ethyl-5-(hexyloxymethyl)-1,3-dioxane-2-one
5-エチル-5-(ヘキシルオキシメチル)-1,3-ジオキサン-2-オン
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： C13H24O4
Molecular formula furigana： C13-H24-O4
Molecular weight： 244.331
InChI：
InChI=1S/C13H24O4/c1-3-5-6-7-8-15-9-13(4-2)10-16-12(14)17-11-13/h3-11H2,1-2H3
InChI key：
OFRWDTUGDZSVRP-UHFFFAOYSA-N
SMILES：
CCCCCCOCC1(CC)COC(=O)OC1
Systematic name (3)：
- 5-エチル-5-(ヘキシルオキシメチル)-1,3-ジオキサン-2-オン
- 5-エチル-5-[(ヘキシルオキシ)メチル]-1,3-ジオキサン-2-オン
- 5-ethyl-5-[(hexyloxy)methyl]-1,3-dioxan-2-one
- 5-Ethyl-5-(hexyloxymethyl)-1,3-dioxane-2-one
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