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    Technical details about Isooctadecanol, learn more about the structure, uses, toxicity, action, side effects and more

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    Isooctadecanol

    PharmaCompass

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    2D Structure
    1. Also known as: Isostearyl alcohol, Isooctadecanol, 27458-93-1, Isooctadecan-1-ol, Isooctadecyl alcohol, 16-methylheptadecanol
    Molecular Formula
    C18H38O
    Molecular Weight
    270.5  g/mol
    InChI Key
    WNWHHMBRJJOGFJ-UHFFFAOYSA-N
    FDA UNII
    W29XHH208C
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    16-methylheptadecan-1-ol
    2.1.2 InChI
    InChI=1S/C18H38O/c1-18(2)16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19/h18-19H,3-17H2,1-2H3
    2.1.3 InChI Key
    WNWHHMBRJJOGFJ-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(C)CCCCCCCCCCCCCCCO
    2.2 Other Identifiers
    2.2.1 UNII
    W29XHH208C
    2.3 Synonyms
    2.3.1 MeSH Synonyms

    1. Isooctadecyl Alcohol

    2. Isostearyl Alcohol

    2.3.2 Depositor-Supplied Synonyms

    1. Isostearyl Alcohol

    2. Isooctadecanol

    3. 27458-93-1

    4. Isooctadecan-1-ol

    5. Isooctadecyl Alcohol

    6. 16-methylheptadecanol

    7. 41744-75-6

    8. 1-heptadecanol, 16-methyl-

    9. 16-methyl-1-heptadecanol

    10. Isostearylalcohol

    11. Isostearyl Alcohol [usan]

    12. W29xhh208c

    13. Chebi:84911

    14. Isostearyl Alcohol (usan)

    15. Einecs 248-470-8

    16. Unii-q613ocq44y

    17. Unii-w29xhh208c

    18. Witcohol 66

    19. Einecs 255-529-1

    20. Jarcol I-18t

    21. Witcohol 66 (tn)

    22. Ec 248-470-8

    23. Schembl8716

    24. Q613ocq44y

    25. Chembl2107291

    26. Dtxsid80892268

    27. Zinc4521611

    28. Bs-49227

    29. Db-047225

    30. Ft-0627517

    31. D04633

    32. F71170

    33. 458i931

    34. W-110704

    35. Q27158175

    2.4 Create Date
    2005-08-08
    3 Chemical and Physical Properties
    Molecular Weight 270.5 g/mol
    Molecular Formula C18H38O
    XLogP38.1
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count1
    Rotatable Bond Count15
    Exact Mass270.292265831 g/mol
    Monoisotopic Mass270.292265831 g/mol
    Topological Polar Surface Area20.2 Ų
    Heavy Atom Count19
    Formal Charge0
    Complexity154
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count0
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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