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CS-W001157 4
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Benzyl (2-oxocyclohexyl)carbamate

  • CAS No. 31236-61-0

  • Cat. No. CS-0210706
  • Purity≥97%
  • MDL No.MFCD08061946

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

Benzyl (2-oxocyclohexyl)carbamate|CS-0210706

Structure of 31236-61-0

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General Information

  • CAS No. 31236-61-0
  • Cat. No. CS-0210706
  • Purity ≥97%
  • MDL No. MFCD08061946
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₇NO₃
  • Molecular Weight 247.29
  • Synonym(s) Carbamic acid, N-(2-oxocyclohexyl)-, phenylmethyl ester
  • SMILES O=C(OCC1=CC=CC=C1)NC2C(CCCC2)=O

Synthesis

  • Route1
    • Benzyl n-(2-hydroxycyclohexyl)carbamate|CS-0258991
      92645-06-2
    • ~%
    • Benzyl (2-oxocyclohexyl)carbamate|CS-0210706
      31236-61-0

    References

    • Bersot, Ross; Humphries, Paul Patent: US2013/303524 A1, 2013 ; Location in patent: Paragraph 0423-0424 ;
  • Route2

    References

    • Bersot, Ross; Humphries, Paul Patent: US2013/303524 A1, 2013 ;
  • Route3
    • null|null
      286-20-4
    • ~%
    • Benzyl (2-oxocyclohexyl)carbamate|CS-0210706
      31236-61-0

    References

    • Angle, Steven R.; Arnaiz, Damian O. Tetrahedron Letters, 1989 , vol. 30, # 5 p. 515 - 518

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   55.4
  • LogP   2.4245
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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