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CS-W001157 4
Total: USD 88.00

o,p-Dichlorobenzylamine

  • CAS No. 95-00-1

  • Cat. No. CS-0031349
  • Purity≥98%
  • MDL No.MFCD00008109

*For research and further manufacturing use only, not for direct human use.

o,p-Dichlorobenzylamine|CS-0031349

Structure of 95-00-1

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General Information

  • CAS No. 95-00-1
  • Cat. No. CS-0031349
  • Purity ≥98%
  • MDL No. MFCD00008109
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇Cl₂N
  • Molecular Weight 176.04
  • Synonym(s) NSC 25064; 2,4-Dichlorobenzylamine
  • SMILES NCC1=C(C=C(C=C1)Cl)Cl

Description

(2,4-Dichlorophenyl)methanamine is a bench-stable arylamine featuring two chlorine substituents at the ortho and para positions relative to the amino-methyl group. This electron-deficient aromatic scaffold enables direct incorporation into pharmaceutical intermediates and bioactive molecule frameworks via nucleophilic substitution or coupling reactions under standard conditions.

Application

(2,4-Dichlorophenyl)methanamine serves as a valuable building block in medicinal chemistry, enabling the construction of bioactive heterocycles and pharmaceutical intermediates. Its dual chloro substituents enhance electrophilic substitution reactivity while maintaining bench stability and compatibility with standard coupling protocols. The primary amine functionality facilitates straightforward derivatization via acylation, alkylation, or reductive amination, supporting efficient access to diverse compound libraries.

Synthesis

  • Route1

    References

    • Nabid, Mohammad Reza; Bide, Yasamin; Niknezhad, Mahvash ChemCatChem, 2014 , vol. 6, # 2 p. 538 - 546
  • Route2
    • N-[(2,4-Dichlorophenyl)methylidene]hydroxylamine|CS-0235447
      56843-28-8
    • ~96%
    • In-stock
      o,p-Dichlorobenzylamine|CS-0031349
      95-00-1

    References

    • Zeynizadeh, Behzad; Kouhkan, Mehri Bulletin of the Korean Chemical Society, 2011 , vol. 32, # 9 p. 3448 - 3452
  • Route3
    • In-stock
      2,4-Dichlorobenzonitrile|CS-W017635
      6574-98-7
    • ~86%
    • null|null
      21913-08-6
    • In-stock
      o,p-Dichlorobenzylamine|CS-0031349
      95-00-1

    References

    • Synthetic Communications, , vol. 32, # 8 p. 1265 - 1269

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅲ
Hazard Statements : H314
Precautionary Statements : P264-P280-P301+P330+P331-P304+P340-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.4521
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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