Cas no 1133-49-9 (2,3,4-Trimethoxybenzyl Chloride)

2,3,4-Trimethoxybenzyl Chloride is a versatile organic compound commonly used as an intermediate in pharmaceutical and fine chemical synthesis. Its key advantages include a stable trimethoxybenzyl group, which enhances reactivity in nucleophilic substitution reactions, and its utility in constructing complex molecular frameworks. The chloride moiety provides a reactive handle for further functionalization, making it valuable in the preparation of active pharmaceutical ingredients (APIs) and specialty chemicals. The compound exhibits good solubility in common organic solvents, facilitating its use in diverse synthetic applications. Its well-defined structure and consistent purity ensure reliable performance in multi-step synthesis processes.
2,3,4-Trimethoxybenzyl Chloride structure
1133-49-9 structure
Product Name:2,3,4-Trimethoxybenzyl Chloride
CAS No:1133-49-9
MF:C10H13ClO3
MW:216.661422491074
MDL:MFCD09745133
CID:175412
PubChem ID:97491
Update Time:2025-05-27

2,3,4-Trimethoxybenzyl Chloride Chemical and Physical Properties

Names and Identifiers

    • Benzene,1-(chloromethyl)-2,3,4-trimethoxy-
    • 1-(chloromethyl)-2,3,4-trimethoxybenzene
    • 1-CHLOROMETHYL-2,3,4-TRIMETHOXYBENZENE
    • 2,?3,?4-?Trimethoxybenzyl chloride
    • 2,3,4-Trimethoxybenzylchlorid
    • 2,3,4-Trimethoxy-benzylchlorid
    • 2,3,4-trimethoxybenzylchloride
    • AC1L3YMF
    • AC1Q3U79
    • A-chloro-2,3,4-trimethoxytoluene
    • AR-1L8533
    • CTK4A8269
    • NSC127395
    • SureCN3891419
    • Trimethoxybenzylchloride
    • AKOS000262077
    • DTXSID40150351
    • NSC 127395
    • 1133-49-9
    • HEAQHTKDZPKODU-UHFFFAOYSA-N
    • NSC-127395
    • AS-65663
    • D96010
    • alpha-Chloro-2,3,4-trimethoxytoluene
    • BAA13349
    • Toluene, alpha-chloro-2,3,4-trimethoxy-
    • 2,3,4-trimethoxybenzyl chloride
    • EN300-1967235
    • SCHEMBL3891419
    • 2,3,4-Trimethoxybenzyl Chloride
    • MDL: MFCD09745133
    • Inchi: 1S/C10H13ClO3/c1-12-8-5-4-7(6-11)9(13-2)10(8)14-3/h4-5H,6H2,1-3H3
    • InChI Key: HEAQHTKDZPKODU-UHFFFAOYSA-N
    • SMILES: ClCC1C=CC(=C(C=1OC)OC)OC

Computed Properties

  • Exact Mass: 216.05539
  • Monoisotopic Mass: 216.055322
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 165
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 27.7

Experimental Properties

  • Density: 1.145
  • Boiling Point: 284.2°Cat760mmHg
  • Flash Point: 104.6°C
  • Refractive Index: 1.504
  • PSA: 27.69
  • LogP: 2.45120

2,3,4-Trimethoxybenzyl Chloride Pricemore >>

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