Acyloins

Description:

Organic compounds containing an alpha hydroxy ketone. Acyloins are formally derived from reductive coupling of carboxylic acyl groups.

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  1. Humulone
    CAS: 26472-41-3 EC Number: 247-725-0 PubChem CID: 442911 Formula: C21H30O5 Molecular Weight: 362.46
    Liquid Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools. ≥98%
    In Stock Item #: H648732
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    Technical Identifiers
    IUPAC Name
    (6R)-3,5,6-trihydroxy-2-(3-methylbutanoyl)-4,6-bis(3-methylbut-2-enyl)cyclohexa-2,4-dien-1-one
    SMILES
    CC(C)CC(=O)C1=C(C(=C(C(C1=O)(CC=C(C)C)O)O)CC=C(C)C)O
    InChIKey
    VMSLCPKYRPDHLN-OAQYLSRUSA-N
    InChI
    1S/C21H30O5/c1-12(2)7-8-15-18(23)17(16(22)11-14(5)6)20(25)21(26,19(15)24)10-9-13(3)4/h7,9,14,23-24,26H,8,10-11H2,1-6H3/t21-/m1/s1
    Synonyms
    SCHEMBL144835 | Humulone | NCGC00016682-02 | SCHEMBL13629033 | ((r)-3,5,6-trihydroxy-4,6-bis(3-methyl-2-butenyl)-2-(3...
  2. cohumulone
    Moligand™ ? Moligand™ — Aladdin's line of ligands and bioactive small molecules. Use for receptor, pathway, and binding studies needing defined small-molecule tools.
    Out of Stock Item #: C608616
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    Technical Identifiers
    IUPAC Name
    3,5,6-trihydroxy-4,6-bis(3-methylbut-2-enyl)-2-(2-methylpropanoyl)cyclohexa-2,4-dien-1-one
    SMILES
    CC(C)C(=O)C1=C(C(=C(C(C1=O)(CC=C(C)C)O)O)CC=C(C)C)O
    InChIKey
    DRSITEVYZGOOQG-UHFFFAOYSA-N
    InChI
    1S/C20H28O5/c1-11(2)7-8-14-17(22)15(16(21)13(5)6)19(24)20(25,18(14)23)10-9-12(3)4/h7,9,13,22-23,25H,8,10H2,1-6H3
    Synonyms
    5-(alpha,beta-Dibromophenethyl)-5-methylhydantoin | DTXSID701318500 | SCHEMBL13629034 | 2,5-CYCLOHEXADIEN-1-ONE, 3,4,...
  3. Acetoin
    CAS: 513-86-0 EC Number: 208-174-1 Formula: C4H8O2 Molecular Weight: 88.11
    Liquid Analytical standard ? Analytical standard — certified-purity material for quantitative calibration. Use to prepare calibration standards and validate analytical methods. monopolymer
    In Stock Item #: A109411
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    Technical Identifiers
    IUPAC Name
    3-hydroxybutan-2-one
    SMILES
    CC(C(=O)C)O
    InChIKey
    ROWKJAVDOGWPAT-UHFFFAOYSA-N
    InChI
    1S/C4H8O2/c1-3(5)4(2)6/h3,5H,1-2H3
    Synonyms
    3-hydroxy-2-butanone | acetylmethylcarbinol
  4. 3-Hydroxy-3-methyl-2-butanone
    CAS: 115-22-0 EC Number: 204-073-1 Formula: (CH3)2C(OH)COCH3 Molecular Weight: 102.13
    In Stock Item #: H138057
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    Technical Identifiers
    IUPAC Name
    3-hydroxy-3-methylbutan-2-one
    SMILES
    CC(=O)C(C)(C)O
    InChIKey
    BNDRWEVUODOUDW-UHFFFAOYSA-N
    InChI
    1S/C5H10O2/c1-4(6)5(2,3)7/h7H,1-3H3
    Synonyms
    2-Butanone, 3-hydroxy-3-methyl- | NSC 5576 | 3-Hydroxy-3-methyl-2-butanone, 95% anhydrous basis | EINECS 204-073-1 | ...
  5. Acetoin
    CAS: 513-86-0 EC Number: 208-174-1 Formula: C4H8O2 Molecular Weight: 88.11
    ≥97% May exist as crystalline dimer
    In Stock Item #: A109410
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    Technical Identifiers
    IUPAC Name
    3-hydroxybutan-2-one
    SMILES
    CC(C(=O)C)O
    InChIKey
    ROWKJAVDOGWPAT-UHFFFAOYSA-N
    InChI
    1S/C4H8O2/c1-3(5)4(2)6/h3,5H,1-2H3
    Synonyms
    Acetylmethylcarbinol (May exist as crystalline dimer) | 3-Hydroxy-2-butanone (May exist as crystalline dimer)
  6. Propioin
    CAS: 4984-85-4 Formula: C6H12O2 Molecular Weight: 116.16
    In Stock Item #: P121219
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    Technical Identifiers
    IUPAC Name
    4-hydroxyhexan-3-one
    SMILES
    CCC(C(=O)CC)O
    InChIKey
    SKCYVGUCBRYGTE-UHFFFAOYSA-N
    InChI
    1S/C6H12O2/c1-3-5(7)6(8)4-2/h5,7H,3-4H2,1-2H3
    Synonyms
    (+/-)-4-HYDROXY-3-HEXANONE | 4-Hydroxy-3-hexanone | AS-81700 | SB83904 | DTXSID40863474 | Q27103019 | 3-Hexanone, 4-h...
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