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CS-W001157 4
Total: USD 88.00

Phthalan

  • CAS No. 496-14-0

  • Cat. No. CS-W000052
  • Purity≥97%
  • MDL No.MFCD00005932

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

Phthalan|CS-W000052

Structure of 496-14-0

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General Information

  • CAS No. 496-14-0
  • Cat. No. CS-W000052
  • Purity ≥97%
  • MDL No. MFCD00005932
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈O
  • Molecular Weight 120.15
  • Synonym(s) Phthalan, (1,3-Dihydrobenzo[c]furan
  • SMILES C1OCc2ccccc12

Description

Phthalan was used in the synthesis of functionalised benzylic alcohols.

Application

Phthalan serves as a versatile scaffold in synthetic organic chemistry, enabling efficient construction of benzimidazole and other nitrogen-containing heterocycles via cyclization with diamines or amidines. Its stability under standard reaction conditions and compatibility with diverse functional groups facilitate straightforward incorporation into complex molecular architectures. The compound functions as a key building block for medicinal chemistry campaigns targeting bioactive heterocyclic systems.

Synthesis

  • Route1
    • null|null
      420-87-1
    • null|null
      125593-15-9
    • ~%
    • In-stock
      Phthalan|CS-W000052
      496-14-0
    • In-stock
      Phthalide Butylphthalide  Impurity|CS-0228926
      87-41-2
    • 2-(Hydroxymethyl)benzaldehyde|CS-0378150
      55479-94-2
    • null|null
      125593-16-0

    References

    • Journal of Organic Chemistry, , vol. 55, # 8 p. 2325 - 2332
  • Route2
    • null|null
      125593-15-9
    • null|null
      865-48-5
    • ~%
    • In-stock
      Phthalan|CS-W000052
      496-14-0
    • In-stock
      Phthalide Butylphthalide  Impurity|CS-0228926
      87-41-2
    • 2-(Hydroxymethyl)benzaldehyde|CS-0378150
      55479-94-2
    • null|null
      125593-27-3

    References

    • Journal of Organic Chemistry, , vol. 55, # 8 p. 2325 - 2332
  • Route3

    References

    • Chemische Berichte, , vol. 113, # 4 p. 1304 - 1319

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H302
Precautionary Statements : P210-P264-P270-P280-P330-P370+P378-P403-P501

Quality Control

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Computational Chemistry Data

  • TPSA   9.23
  • LogP   1.7168
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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