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    Technical details about 2-Methylbenzyl chloride, learn more about the structure, uses, toxicity, action, side effects and more

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    2-Methylbenzyl chloride

    PRICE INFORMATION

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    2D Structure
    1. Also known as: 552-45-4, 1-(chloromethyl)-2-methylbenzene, Alpha-chloro-o-xylene, O-xylyl chloride, O-methylbenzyl chloride, 1-chloromethyl-2-methyl-benzene
    Molecular Formula
    C8H9Cl
    Molecular Weight
    140.61  g/mol
    InChI Key
    VQRBXYBBGHOGFT-UHFFFAOYSA-N
    FDA UNII
    EQT3V044TW
    1 2D Structure

    2D Structure

    2 Identification
    2.1 Computed Descriptors
    2.1.1 IUPAC Name
    1-(chloromethyl)-2-methylbenzene
    2.1.2 InChI
    InChI=1S/C8H9Cl/c1-7-4-2-3-5-8(7)6-9/h2-5H,6H2,1H3
    2.1.3 InChI Key
    VQRBXYBBGHOGFT-UHFFFAOYSA-N
    2.1.4 Canonical SMILES
    CC1=CC=CC=C1CCl
    2.2 Other Identifiers
    2.2.1 UNII
    EQT3V044TW
    2.3 Synonyms
    2.3.1 Depositor-Supplied Synonyms

    1. 552-45-4

    2. 1-(chloromethyl)-2-methylbenzene

    3. Alpha-chloro-o-xylene

    4. O-xylyl Chloride

    5. O-methylbenzyl Chloride

    6. 1-chloromethyl-2-methyl-benzene

    7. O-(chloromethyl)toluene

    8. 2-(chloromethyl)toluene

    9. Benzene, 1-(chloromethyl)-2-methyl-

    10. O-xylene, .alpha.-chloro-

    11. .alpha.-chloro-o-xylene

    12. .omega.-chloro-o-xylene

    13. O-xylyl-.alpha.-chloride

    14. Eqt3v044tw

    15. 2-methylbenzylchloride

    16. Omega-chloro-o-xylene

    17. O-xylyl-alpha-chloride

    18. O-xylene, Alpha-chloro-

    19. 1-(chloromethyl)-2-methyl-benzene

    20. Unii-eqt3v044tw

    21. O-xylylchlorid

    22. Hsdb 2681

    23. Einecs 209-013-8

    24. O-chloromethyltoluene

    25. Mfcd00000899

    26. Alpha-chloro O-xylene

    27. Alpha-chloro-orthoxylene

    28. 2-methyl-benzyl Chloride

    29. 2-ch3c6h4ch2cl

    30. .alpha.-chloro-ortho-xylene

    31. Dsstox_cid_24441

    32. Dsstox_rid_80231

    33. Dsstox_gsid_44441

    34. Schembl52225

    35. Chloromethyl)-2-methylbenzene

    36. 1-chloromethyl-2-methylbenzene

    37. 1-methyl-2-chloromethylbenzene

    38. O-xylyl Chloride [mi]

    39. 2-methylbenzyl Chloride, 99%

    40. Chembl3183322

    41. Dtxsid5044441

    42. Zinc2034794

    43. Tox21_302160

    44. Stl141068

    45. Akos000121523

    46. Ncgc00255750-01

    47. 26519-66-4

    48. 99765-61-4

    49. Am100941

    50. As-10899

    51. Cas-552-45-4

    52. Db-000160

    53. Bb 0267833

    54. Ft-0632374

    55. A26507

    56. Q15632731

    57. F2190-0256

    58. 1-(chloromethyl)-2-methyl-benzen;2-(chloromethyl)toluene

    59. 8-methoxypyrene-1,3,6-trisulfonicacidtrisodiumsalt

    2.4 Create Date
    2005-03-26
    3 Chemical and Physical Properties
    Molecular Weight 140.61 g/mol
    Molecular Formula C8H9Cl
    XLogP32.9
    Hydrogen Bond Donor Count0
    Hydrogen Bond Acceptor Count0
    Rotatable Bond Count1
    Exact Mass140.0392780 g/mol
    Monoisotopic Mass140.0392780 g/mol
    Topological Polar Surface Area0 Ų
    Heavy Atom Count9
    Formal Charge0
    Complexity80.6
    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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