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CS-W001157 4
Total: USD 88.00

4-Methylbenzylamine

  • CAS No. 104-84-7

  • Cat. No. CS-W022218
  • Molecule weight121.18
  • Purity≥98%
  • MDL No.MFCD00008123

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

4-Methylbenzylamine|CS-W022218

Structure of 104-84-7

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General Information

  • CAS No. 104-84-7
  • Cat. No. CS-W022218
  • Purity ≥98%
  • MDL No. MFCD00008123
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₁N
  • Molecular Weight 121.18
  • Synonym(s) α-Amino-p-xylene
  • SMILES C1=C(CN)C=CC(=C1)C

Description

4-Methylbenzylamine features a benzylamine scaffold with a methyl group at the para position, enhancing electron density and improving stability. This bench-stable compound serves as a key building block in medicinal chemistry, facilitating the synthesis of bioactive molecules through straightforward functionalization.

Application

4-Methylbenzylamine serves as a versatile building block in medicinal chemistry and organic synthesis, enabling the construction of bioactive heterocycles and pharmaceutical intermediates. Its benzylic amine functionality exhibits excellent reactivity in alkylation, acylation, and coupling reactions, while the para-methyl group enhances metabolic stability and lipophilicity. The compound demonstrates good bench stability and ease of purification, making it well-suited for scalable synthetic processes and API development workflows.

Synthesis

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      4-Methylbenzylamine|CS-W022218
      104-84-7

    References

    • Chemische Berichte, , vol. 28, p. 2987
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      4-Methylbenzylamine|CS-W022218
      104-84-7

    References

    • Zhurnal Obshchei Khimii, , vol. 26, p. 2612,2615; engl.Ausg.S.2915,2918
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    References

    • Journal of the Chemical Society, , p. 2249

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅱ
Hazard Statements : H227-H314
Precautionary Statements : P210-P260-P264-P280-P301+P330+P331-P304+P340-P363-P370+P378-P403-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   1.45372
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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