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CS-W001157 4
Total: USD 88.00

tert-Butyl ((1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl)carbamate

  • CAS No. 168960-18-7

  • Cat. No. CS-W022960
  • Molecule weight213.27
  • Purity≥97%
  • MDL No.MFCD01632105

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

tert-Butyl ((1R,4S)-4-(hydroxymethyl)cyclopent-2-en-1-yl)carbamate|CS-W022960

Structure of 168960-18-7

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General Information

  • CAS No. 168960-18-7
  • Cat. No. CS-W022960
  • Purity ≥97%
  • MDL No. MFCD01632105
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₉NO₃
  • Molecular Weight 213.27
  • Synonym(s) CARBAMIC ACID, [4(S)-(HYDROXYMETHYL)-2-CYCLOPENTEN-1-YL]-1,1-DIMETHYLETHYL ESTER, (1R-CIS)-
  • SMILES O=C(OC(C)(C)C)N[C@H]1C=C[C@@H](CO)C1

Synthesis

  • Route1

    References

    • Kudoh, Takashi; Fukuoka, Masayoshi; Ichikawa, Satoshi; Murayama, Takashi; Ogawa, Yasuo; Hashii, Minako; Higashida, Haruhiro; Kunerth, Svenja; Weber, Karin; Guse, Andreas H.; Potter, Barry V. L.; Matsuda, Akira; Shuto, Satoshi Journal of the American Chemical Society, 2005 , vol. 127, # 24 p. 8846 - 8855
  • Route2

    References

    • SmithKline Beecham Corporation Patent: US6392085 B1, 2002 ; Location in patent: Page column 19-20 ;
  • Route3

    References

    • McGuigan, Christopher; Hassan-Abdallah, Alshaimaa; Srinivasan, Sheila; Wang, Yikang; Siddiqui, Adam; Daluge, Susan M.; Gudmundsson, Kristjan S.; Zhou, Huiqiang; McLean, Ed W.; Peckham, Jennifer P.; Burnette, Thimysta C.; Marr, Harry; Hazen, Richard; Condreay, Lynn D.; Johnson, Lance; Balzarini, Jan Journal of Medicinal Chemistry, 2006 , vol. 49, # 24 p. 7215 - 7226

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   58.56
  • LogP   1.4481
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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