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CS-W001157 4
Total: USD 88.00

2-(Benzylamino)-2-methylpropanenitrile

  • CAS No. 99840-51-4

  • Cat. No. CS-0364765
  • Molecule weight174.24
  • Purity≥97%
  • MDL No.None

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

2-(Benzylamino)-2-methylpropanenitrile|CS-0364765

Structure of 99840-51-4

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General Information

  • CAS No. 99840-51-4
  • Cat. No. CS-0364765
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄N₂
  • Molecular Weight 174.24
  • Synonym(s) 2-benzylamino-2-methylpropionitrile
  • SMILES CC(C)(NCC1=CC=CC=C1)C#N

Synthesis

  • Route1
    • null|null
      7677-24-9
    • null|null
      67-64-1
    • null|null
      100-46-9
    • ~64%
    • 2-(Benzylamino)-2-methylpropanenitrile|CS-0364765
      99840-51-4

    References

    • Jenner, Gerard; Salem, Ridha Ben; Kim, Jong Chul; Matsumoto, Kiyoshi Tetrahedron Letters, 2003 , vol. 44, # 3 p. 447 - 449
  • Route2
    • null|null
      75-86-5
    • null|null
      100-46-9
    • ~98%
    • 2-(Benzylamino)-2-methylpropanenitrile|CS-0364765
      99840-51-4

    References

    • De Blieck, Ann; Stevens, Christian V. Synlett, 2011 , # 12 p. 1748 - 1752
  • Route3
    • null|null
      123-72-8
    • null|null
      75-86-5
    • null|null
      100-46-9
    • ~20%
    • null|null
      56249-49-1
    • 2-(Benzylamino)-2-methylpropanenitrile|CS-0364765
      99840-51-4

    References

    • Galletti, Paola; Pori, Matteo; Giacomini, Daria European Journal of Organic Chemistry, 2011 , # 20-21 p. 3896 - 3903

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   35.82
  • LogP   2.07838
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   3

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