Account 3-butyl-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one
- Catalog No. :
- ACQAAX735
- CAS No. :
- 6415-59-4
- Molecular Formula :
- C12H18O2
- Molecular Weight :
- 194.27
IUPAC Name:3-butyl-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one
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Product Information
| Product Name | 3-butyl-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one |
|---|---|
| IUPAC Name | 3-butyl-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one |
| MDL No. | MFCD00171327 |
| Molecular Formula | C12H18O2 |
| Molecular Weight | 194.27 |
| SMILES | CCCCC1OC(=O)C2=CCCCC21 |
| InChI Key | UPJFTVFLSIQQAV-UHFFFAOYSA-N |
| Synonym | 3-butyl-3a,4,5,6-tetrahydro-3H-2-benzofuran-1-one | AC-34894 | 3-butyl-3a,4,5,6-tetrahydro-3H-2-benzouran-1-one | CCRIS 7108 | CHEBI:167849 | SCHEMBL7651293 | UPJFTVFLSIQQAV-UHFFFAOYSA-N | Q21099594 | trans-Neocnidilide | 3-butyl-1,3,3a,4,5,6-hexahydro-2- |
| CAS No. | 6415-59-4 |
Synthetic Route by SureRoute
2. ACQAAX735 Molecular Building Block Synthetic Route
(3S,3aR)-3-Butyl-3a,4,5,6-tetrahydroisobenzofuran-1(3H)-one
(3AS,6Z,10E,11aR)-10-methyl-3-methylene-2-oxo-2,3,3a,4,5,8,9,11a-octahydrocyclodeca[b]furan-6-carboxylic acid
(3aS,4R,10R,11aR,E)-6,10-bis(hydroxymethyl)-3-methylene-2-oxo-2,3,3a,4,5,8,9,10,11,11a-decahydrocyclodeca[b]furan-4-yl (Z)-2-methylbut-2-enoate