Chem
J-GLOBAL ID:200907024459939586   Nikkaji number:J1.646.708A

(E)-5-[(4R,5S)-2,2-Dimethyl-5-iodo-1,3-dioxane-4-yl]-2-pentenoic acid ethyl ester

(E)-5-[(4R,5S)-2,2-ジメチル-5-ヨード-1,3-ジオキサン-4-イル]-2-ペンテン酸エチル
Substance type:
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
Molecular formula: C13H21IO4
Molecular formula furigana: C13-H21-I-O4
Molecular weight: 368.211
InChI: InChI=1S/C13H21IO4/c1-4-16-12(15)8-6-5-7-11-10(14)9-17-13(2,3)18-11/h6,8,10-11H,4-5,7,9H2,1-3H3/b8-6+/t10-,11+/m0/s1
InChI key: DDQZKWFSYGZFED-YBFGJNSCSA-N
SMILES: CCOC(=O)/C=C/CC[C@H]1OC(C)(C)OC[C@@H]1I
Systematic name  (3):
  • (E)-5-[(4R,5S)-2,2-ジメチル-5-ヨード-1,3-ジオキサン-4-イル]-2-ペンテン酸エチル
  • エチル (2E)-5-[(4R,5S)-5-ヨード-2,2-ジメチル-1,3-ジオキサン-4-イル]ペンタ-2-エノアート
  • ethyl (2E)-5-[(4R,5S)-5-iodo-2,2-dimethyl-1,3-dioxan-4-yl]pent-2-enoate
Other name (1):
  • (E)-5-[(4R,5S)-2,2-Dimethyl-5-iodo-1,3-dioxane-4-yl]-2-pentenoic acid ethyl ester
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