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CS-W001157 4
Total: USD 88.00

4-Isopropoxy-2-methylbenzaldehyde

  • CAS No. 86786-25-6

  • Cat. No. CS-0196273
  • Molecule weight178.23
  • Purity≥98%
  • MDL No.None

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

4-Isopropoxy-2-methylbenzaldehyde|CS-0196273

Structure of 86786-25-6

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General Information

  • CAS No. 86786-25-6
  • Cat. No. CS-0196273
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₂
  • Molecular Weight 178.23
  • Synonym(s) 2-methyl-4-propan-2-yloxybenzaldehyde
  • SMILES O=CC1=CC=C(OC(C)C)C=C1C

Synthesis

  • Route1
    • 1-Isopropoxy-3-methylbenzene|CS-0046837
      19177-04-9
    • null|null
      68-12-2
    • ~26%
    • 4-Isopropoxy-2-methylbenzaldehyde|CS-0196273
      86786-25-6

    References

    • FOREST LABORATORIES HOLDINGS LIMITED; SARMA, Pakala, Kumara Savithru; ACHARYA, Vinod, Parameshwaran; KASIBHATLA, Srinivas, Rao; VISWANADHAN, Vellarkad, Narayana; SHEKHAR, Polisetti; BISCHOFF, Alexander Patent: WO2010/127212 A1, 2010 ; Location in patent: Page/Page column 39 ;
  • Route2
    • 1-Isopropoxy-3-methylbenzene|CS-0046837
      19177-04-9
    • ~%
    • 4-Isopropoxy-2-methylbenzaldehyde|CS-0196273
      86786-25-6

    References

    • Pearson, Anthony J.; Perrior, Trevor R.; Griffin, David A. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1983 , p. 625 - 631
  • Route3
    • 1-Bromo-2-methyl-4-(propan-2-yloxy)benzene|CS-0070794
      86786-24-5
    • null|null
      68-12-2
    • ~%
    • 4-Isopropoxy-2-methylbenzaldehyde|CS-0196273
      86786-25-6

    References

    • Pearson, Anthony J.; Perrior, Trevor R.; Griffin, David A. Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1983 , p. 625 - 631

Safety Information

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GHS Pictogram : N/A
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Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   2.59472
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   3

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