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CS-W001157 4
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2-Methoxycyclohexan-1-one

  • CAS No. 7429-44-9

  • Cat. No. CS-0183772
  • Purity≥97%
  • MDL No.None

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

2-Methoxycyclohexan-1-one|CS-0183772

Structure of 7429-44-9

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General Information

  • CAS No. 7429-44-9
  • Cat. No. CS-0183772
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂O₂
  • Molecular Weight 128.17
  • Synonym(s) 2-Methoxycyclohexanone
  • SMILES COC1CCCCC1=O

Description

The conformational equilibrium of 2-methoxycyclohexanone was studied by infrared spectroscopy.2-Methoxycyclohexanone was used in the synthesis of 2-(carbomethoxy)cyclohex-2-en-1-one.

Synthesis

  • Route1

    References

    • CPC International Inc. Patent: US29201 E1, 1977 ;
  • Route2
    • Guaiacol Guaifenesin Impurity|CS-0229801
      90-05-1
    • ~%
    • In-stock
      2-Methoxycyclohexan-1-one|CS-0183772
      7429-44-9

    References

    • Zhao, Chen; Kou, Yuan; Lemonidou, Angeliki A.; Li, Xuebing; Lercher, Johannes A. Angewandte Chemie, International Edition, 2009 , vol. 48, p. 3987 - 3990 Angewandte Chemie, 2009 , vol. 121, p. 4047 - 4050
  • Route3

    References

    • Nakagawa, Yoshinao; Ishikawa, Momoko; Tamura, Masazumi; Tomishige, Keiichi Green Chemistry, 2014 , vol. 16, # 4 p. 2197 - 2203

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

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Computational Chemistry Data

  • TPSA   26.3
  • LogP   1.1445
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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