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1,3-dicarbonyl compounds

Description:

Carbonyl compounds with the generic formula O=C(R)C(H)C(R')=O, where R and R' can be any group.

Ancestors:

Organic compounds ⮕ Organic oxygen compounds ⮕ Organooxygen compounds ⮕ Carbonyl compounds ⮕ 1,3-dicarbonyl compounds

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  1. 4-(Pent-4-yn-1-yl)cyclohexane-1,3-dione
    4-(Pent-4-yn-1-yl)cyclohexane-1,3-dione
    CAS: 1354630-46-8 Formula: C11H14O2 Molecular Weight: 178.230
    ≥99%
    Out of Stock Item #: P1009045
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    Technical Identifiers
    IUPAC Name
    4-pent-4-ynylcyclohexane-1,3-dione
    SMILES
    C#CCCCC1CCC(=O)CC1=O
    InChIKey
    UNMICBPHYXLMRA-UHFFFAOYSA-N
    InChI
    1S/C11H14O2/c1-2-3-4-5-9-6-7-10(12)8-11(9)13/h1,9H,3-8H2
  2. Ethyl 2-oxocyclopentanecarboxylate
    Ethyl 2-oxocyclopentanecarboxylate
    CAS: 611-10-9 EC Number: 210-253-0 Formula: C8H12O3 Molecular Weight: 156.18
    ≥95%
    In Stock Item #: E736673
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    Technical Identifiers
    IUPAC Name
    ethyl 2-oxocyclopentane-1-carboxylate
    SMILES
    CCOC(=O)C1CCCC1=O
    InChIKey
    JHZPNBKZPAWCJD-UHFFFAOYSA-N
    InChI
    1S/C8H12O3/c1-2-11-8(10)6-4-3-5-7(6)9/h6H,2-5H2,1H3
    Synonyms
    2-(Ethoxycarbonyl)cyclopentanone Ethyl cyclopentanone-2-carboxylate 2-Carbethoxycyclopentanone 2-Ethoxycarbonylcyclop...
  3. Methyl 4，4-dimethyl-2-oxocyclopentanecarboxylate
    Methyl 4，4-dimethyl-2-oxocyclopentanecarboxylate
    CAS: 60585-44-6 PubChem CID: 11789638 Formula: C9H14O3 Molecular Weight: 170.21
    ≥95%
    Out of Stock Item #: M726278
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    Technical Identifiers
    IUPAC Name
    methyl 4,4-dimethyl-2-oxocyclopentane-1-carboxylate
    SMILES
    CC1(CC(C(=O)C1)C(=O)OC)C
    InChIKey
    XWEUDAXDKUDFMQ-UHFFFAOYSA-N
    InChI
    1S/C9H14O3/c1-9(2)4-6(7(10)5-9)8(11)12-3/h6H,4-5H2,1-3H3
  4. Methyl 4，4-dimethyl-2-oxocyclohexanecarboxylate
    Methyl 4，4-dimethyl-2-oxocyclohexanecarboxylate
    CAS: 32767-46-7 PubChem CID: 5314361 Formula: C10H16O3 Molecular Weight: 184.23
    ≥95%
    Out of Stock Item #: M709617
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    Technical Identifiers
    IUPAC Name
    methyl 4,4-dimethyl-2-oxocyclohexane-1-carboxylate
    SMILES
    CC1(CCC(C(=O)C1)C(=O)OC)C
    InChIKey
    BHMOBBBEXFZLKW-UHFFFAOYSA-N
    InChI
    1S/C10H16O3/c1-10(2)5-4-7(8(11)6-10)9(12)13-3/h7H,4-6H2,1-3H3
  5. Ethyl 2,4-dioxo-6-phenylcyclohexanecarboxylate
    Ethyl 2,4-dioxo-6-phenylcyclohexanecarboxylate
    CAS: 56540-06-8 PubChem CID: 12617805 Formula: C15H16O4 Molecular Weight: 260.29
    ≥95%
    Out of Stock Item #: E736165
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    Technical Identifiers
    IUPAC Name
    ethyl 2,4-dioxo-6-phenylcyclohexane-1-carboxylate
    SMILES
    CCOC(=O)C1C(CC(=O)CC1=O)C2=CC=CC=C2
    InChIKey
    BXVBHUOYUZLPLZ-UHFFFAOYSA-N
    InChI
    1S/C15H16O4/c1-2-19-15(18)14-12(8-11(16)9-13(14)17)10-6-4-3-5-7-10/h3-7,12,14H,2,8-9H2,1H3
  6. 5，5-Dimethylpyrrolidine-2，4-dione
    5，5-Dimethylpyrrolidine-2，4-dione
    CAS: 89464-41-5 PubChem CID: 13346709 Formula: C6H9NO2 Molecular Weight: 127.14
    ≥98%
    Out of Stock Item #: D727450
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    Technical Identifiers
    IUPAC Name
    5,5-dimethylpyrrolidine-2,4-dione
    SMILES
    CC1(C(=O)CC(=O)N1)C
    InChIKey
    VZRDHBPVJBGCAX-UHFFFAOYSA-N
    InChI
    1S/C6H9NO2/c1-6(2)4(8)3-5(9)7-6/h3H2,1-2H3,(H,7,9)
  7. 1，3-Dicyclopropylpropane-1，3-dione
    1，3-Dicyclopropylpropane-1，3-dione
    CAS: 30923-64-9 PubChem CID: 13780782 Formula: C9H12O2 Molecular Weight: 152.19
    ≥98%
    Out of Stock Item #: D727688
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    Technical Identifiers
    IUPAC Name
    1,3-dicyclopropylpropane-1,3-dione
    SMILES
    C1CC1C(=O)CC(=O)C2CC2
    InChIKey
    QSEFTOYPSHMMDG-UHFFFAOYSA-N
    InChI
    1S/C9H12O2/c10-8(6-1-2-6)5-9(11)7-3-4-7/h6-7H,1-5H2
  8. 1-cyclopropyl-4,4,4-trifluoro-1,3-butanedione
    1-cyclopropyl-4,4,4-trifluoro-1,3-butanedione
    CAS: 30923-69-4 PubChem CID: 11194673 Formula: C7H7F3O2 Molecular Weight: 180.13
    Liquid ≥98%
    Out of Stock Item #: C725684
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    Technical Identifiers
    IUPAC Name
    1-cyclopropyl-4,4,4-trifluorobutane-1,3-dione
    SMILES
    C1CC1C(=O)CC(=O)C(F)(F)F
    InChIKey
    LTTCLMXHNACGKU-UHFFFAOYSA-N
    InChI
    1S/C7H7F3O2/c8-7(9,10)6(12)3-5(11)4-1-2-4/h4H,1-3H2
    Synonyms
    1-cyclopropyl-4,4,4-trifluoro-1,3-butanedione
  9. methyl 2-oxocyclooctanecarboxylate
    methyl 2-oxocyclooctanecarboxylate
    CAS: 5452-73-3 PubChem CID: 227411 Formula: C10H16O3 Molecular Weight: 184.23
    ≥95%
    Out of Stock Item #: M696503
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    Technical Identifiers
    IUPAC Name
    methyl 2-oxocyclooctane-1-carboxylate
    SMILES
    COC(=O)C1CCCCCCC1=O
    InChIKey
    FAADEEISKNEKDP-UHFFFAOYSA-N
    InChI
    1S/C10H16O3/c1-13-10(12)8-6-4-2-3-5-7-9(8)11/h8H,2-7H2,1H3
  10. ethyl 3-bromo-2-oxocyclohexanecarboxylate - ≥95% CAS No(30132-23-1) by Aladdin Scientific
    Ethyl 3-bromo-2-oxocyclohexanecarboxylate
    CAS: 30132-23-1 EC Number: 250-065-6 Formula: C9H13BrO3 Molecular Weight: 249.10
    Liquid ≥95%
    Out of Stock Item #: E695636
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    Technical Identifiers
    IUPAC Name
    ethyl 3-bromo-2-oxocyclohexane-1-carboxylate
    SMILES
    CCOC(=O)C1CCCC(C1=O)Br
    InChIKey
    VKCMWLOBUILIOQ-UHFFFAOYSA-N
    InChI
    1S/C9H13BrO3/c1-2-13-9(12)6-4-3-5-7(10)8(6)11/h6-7H,2-5H2,1H3
  11. Prohexadione
    Prohexadione
    CAS: 88805-35-0 EC Number: 618-212-2 PubChem CID: 184900
    ≥95%
    Out of Stock Item #: P696214
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    Technical Identifiers
    IUPAC Name
    3,5-dioxo-4-propanoylcyclohexane-1-carboxylic acid
    SMILES
    CCC(=O)C1C(=O)CC(CC1=O)C(=O)O
    InChIKey
    BUCOQPHDYUOJSI-UHFFFAOYSA-N
    InChI
    1S/C10H12O5/c1-2-6(11)9-7(12)3-5(10(14)15)4-8(9)13/h5,9H,2-4H2,1H3,(H,14,15)
  12. 2，8-Dimethylnonane-4，6-dione
    2，8-Dimethylnonane-4，6-dione
    CAS: 7307-08-6 PubChem CID: 581379 Formula: C11H20O2 Molecular Weight: 184.27
    ≥97%
    Out of Stock Item #: D698170
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    Pricing & Pack Sizes
    Technical Identifiers
    IUPAC Name
    2,8-dimethylnonane-4,6-dione
    SMILES
    CC(C)CC(=O)CC(=O)CC(C)C
    InChIKey
    GJMUCDMIIVSROW-UHFFFAOYSA-N
    InChI
    1S/C11H20O2/c1-8(2)5-10(12)7-11(13)6-9(3)4/h8-9H,5-7H2,1-4H3
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