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    Also known as: 28221-20-7, 89-47-4, Menthyl isovalerate, (-)-, Butanoic acid, 3-methyl-, (1r,2s,5r)-5-methyl-2-(1-methylethyl)cyclohexyl ester, Menthyl isovalerate, (+/-)-, [(1r,2s,5r)-5-methyl-2-propan-2-ylcyclohexyl] 3-methylbutanoate
    Molecular Formula
    C15H28O2
    Molecular Weight
    240.38  g/mol
    InChI Key
    VYQSSWZYPCCBRN-HZSPNIEDSA-N
    FDA UNII
    P5M0O284O6
    Menthyl Isovalerate, (-)-
    1 2D Structure

    Menthyl Isovalerate, (-)-

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    [(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl] 3-methylbutanoate
    2.1.2 InChI
    InChI=1S/C15H28O2/c1-10(2)8-15(16)17-14-9-12(5)6-7-13(14)11(3)4/h10-14H,6-9H2,1-5H3/t12-,13+,14-/m1/s1
    2.1.3 InChI Key
    VYQSSWZYPCCBRN-HZSPNIEDSA-N
    2.1.4 Canonical SMILES
    CC1CCC(C(C1)OC(=O)CC(C)C)C(C)C
    2.1.5 Isomeric SMILES
    C[C@@H]1CC[C@H]([C@@H](C1)OC(=O)CC(C)C)C(C)C
    2.2 Other Identifiers
    2.2.1 UNII
    P5M0O284O6
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. 3-p-menthyl Isovalerate

    2. Validol, (1alpha,2beta,5alpha)-isomer

    3. Validol, (1r-(1alpha,2beta,5alpha))-isomer

    2.3.2 Depositor-Supplied Synonyms

    1. 28221-20-7

    2. 89-47-4

    3. Menthyl Isovalerate, (-)-

    4. Butanoic Acid, 3-methyl-, (1r,2s,5r)-5-methyl-2-(1-methylethyl)cyclohexyl Ester

    5. Menthyl Isovalerate, (+/-)-

    6. [(1r,2s,5r)-5-methyl-2-propan-2-ylcyclohexyl] 3-methylbutanoate

    7. P5m0o284o6

    8. Butanoic Acid, 3-methyl-, (1r,2s,5r)-5-methyl-2-(1-methylethyl)cyclohexyl Ester, Rel-

    9. E6qe751102

    10. Menthol Isovalerate

    11. Unii-p5m0o284o6

    12. Einecs 248-911-4

    13. L-menthyl Isovalerate

    14. Dl-menthyl Isovalerate

    15. Schembl873739

    16. Menthyl Isovalerate [mi]

    17. Unii-e6qe751102

    18. Fema 2669

    19. Dtxsid90883268

    20. Dtxsid90893827

    21. Menthyl Valerate [who-dd]

    22. Menthyl Isovalerate [fhfi]

    23. P- Menth-3-yl Isovalerate

    24. Menthyl Isovalerate [mart.]

    25. Zinc4216848

    26. Einecs 201-910-2

    27. Menthyl Isovalerate Racemate [mi]

    28. Fema No. 4156, (-)-

    29. Fema No. 4156, (+/-)-

    30. (1r,2s,5r)-2-isopropyl-5-methylcyclohexyl 3-methylbutanoate

    31. (1r,2s,5r)-5-methyl-2-(propan-2-yl)cyclohexyl 3-methylbutanoate

    32. Rel-(1r,2s,5r)-2-isopropyl-5-methylcyclohexyl 3-methylbutanoate

    33. (1r-(1alpha,2beta,5alpha))-2-isopropenyl-5-methylcyclohexyl Isovalerate

    34. Butanoic Acid, 3-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl Ester, (1alpha,2beta,5alpha)-

    35. Butanoic Acid, 3-methyl-, 5-methyl-2-(1-methylethyl)cyclohexyl Ester, (1r-(1.alpha.,2.beta.,5.alpha.))-

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 240.38 g/mol
    Molecular Formula C15H28O2
    XLogP34.9
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count5
    Exact Mass240.208930132 g/mol
    Monoisotopic Mass240.208930132 g/mol
    Topological Polar Surface Area26.3 Ų
    Heavy Atom Count17
    Formal Charge0
    Complexity245
    Isotope Atom Count0
    Defined Atom Stereocenter Count3
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1

    API SUPPLIERS

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    01

    Farmak JSC

    Ukraine

    USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

    SupplySide West 2024
    Not Confirmed
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    Farmak JSC

    Ukraine

    USDMF, CEP/COS, JDMF, EU-WC, NDC, KDMF, VMF, Others

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    SupplySide West 2024
    Not Confirmed
    USDMF CEP/COS JDMF EU-WC NDC KDMF VMF Others AUDIT
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    Farmak JSC

    Ukraine
    SupplySide West 2024
    Not Confirmed
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    Farmak JSC

    Ukraine
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    SupplySide West 2024
    Not Confirmed
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    Menthyl isovalerate, (-)-

    About the Company : Farmak International is a leading GMP EU certified pharmaceutical manufacturer in Ukraine established in 1925 with FDA inspected site for production of food supplement. Company spe...

    Farmak International is a leading GMP EU certified pharmaceutical manufacturer in Ukraine established in 1925 with FDA inspected site for production of food supplement. Company specialization is full-cycle production of finished dosage forms products for endocrinology, cardiology, rheumatology, ophthalmology and respiratory diseases; including anesthetics and radiopaque contrast media. Thanks to a strong research base and substantial investments in its production facilities, Farmak International possesses a considerable portfolio of high quality products and is open to cooperation, including but not limited to private labeling, in- and out-licensing, technologies transfers, R&D and contract manufacturing.
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