Chem
J-GLOBAL ID：200907034755683509
Nikkaji number：J1.198.335I
Malonic acid 1-allyl 3-ethyl ester
マロン酸1-アリル3-エチル
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： C8H12O4
Molecular formula furigana： C8-H12-O4
Molecular weight： 172.180
InChI：
InChI=1S/C8H12O4/c1-3-5-12-8(10)6-7(9)11-4-2/h3H,1,4-6H2,2H3
InChI key：
SYPWMMODBPCIMR-UHFFFAOYSA-N
SMILES：
CCOC(=O)CC(=O)OCC=C
Systematic name (4)：
- プロパン二酸1-エチル3-アリル
- マロン酸1-アリル3-エチル
- 1-エチル 3-プロパ-2-エン-1-イル プロパンジオアート
- 1-ethyl 3-prop-2-en-1-yl propanedioate
- Propanedioic acid 1-ethyl 3-allyl ester
- Malonic acid 1-allyl 3-ethyl ester
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