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    Technical details about CAS 35205-54-0, learn more about the structure, uses, toxicity, action, side effects and more

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    CAS 35205-54-0

    Manufacturers/Suppliers

    PharmaCompass

    Farmhispania Group, a leading European CDMO in HPAPI Technologies & High Potency Fermentation.

    One Pharma aims to be one of the leading generic companies in Europe.

    2D Structure
    1. Also known as: 1-phenoxypropan-2-amine, 35205-54-0, 1-phenoxy-2-propanamine, 1-methyl-2-phenoxy-ethylamine, 2-phenoxyisopropylamine, 2-propanamine, 1-phenoxy-
    Molecular Formula
    C9H13NO
    Molecular Weight
    151.21  g/mol
    InChI Key
    IKYFHRVPKIFGMH-UHFFFAOYSA-N
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-phenoxypropan-2-amine
    2.1.2 InChI
    InChI=1S/C9H13NO/c1-8(10)7-11-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
    2.1.3 InChI Key
    IKYFHRVPKIFGMH-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC(COC1=CC=CC=C1)N
    2.2 Synonyms
    2.2.1 Depositor-Supplied Synonyms

    1. 1-phenoxypropan-2-amine

    2. 35205-54-0

    3. 1-phenoxy-2-propanamine

    4. 1-methyl-2-phenoxy-ethylamine

    5. 2-phenoxyisopropylamine

    6. 2-propanamine, 1-phenoxy-

    7. 1-phenoxy-2-propylamine

    8. Ethylamine, 1-methyl-2-phenoxy-

    9. C 1926

    10. Nsc 137777

    11. Einecs 252-434-7

    12. Brn 2045304

    13. (1-methyl-2-phenoxyethyl)amine

    14. Phenoxyisopropylamine

    15. 1-phenoxypropane-2-amine

    16. 2-amino-1-phenoxypropane

    17. 2-phenoxy-1-methylethylamine

    18. 4-06-00-00669 (beilstein Handbook Reference)

    19. Schembl366154

    20. 1-methyl-2-phenoxyethyl Amine

    21. Ethylamine, Methyl-2-phenoxy-

    22. Chembl162135

    23. Dtxsid301313534

    24. .alpha.-methyl-2-phenoxyethanamine

    25. Albb-027081

    26. Mfcd00008083

    27. Nsc137777

    28. Akos000302300

    29. Akos016042140

    30. Nsc-137777

    31. Sb76412

    32. Ls-09259

    33. Bb 0255191

    34. Cs-0433311

    35. Ft-0678798

    36. N12753

    37. Ab01007136-01

    2.3 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 151.21 g/mol
    Molecular Formula C9H13NO
    XLogP31.6
    Hydrogen Bond Donor Count1
    Hydrogen Bond Acceptor Count2
    Rotatable Bond Count3
    Exact Mass g/mol
    Monoisotopic Mass g/mol
    Topological Polar Surface Area35.2
    Heavy Atom Count11
    Formal Charge0
    Complexity99.7
    Isotope Atom Count0
    Defined Atom Stereocenter Count0
    Undefined Atom Stereocenter Count1
    Defined Bond Stereocenter Count0
    Undefined Bond Stereocenter Count0
    Covalently Bonded Unit Count1
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