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CS-W001157 4
Total: USD 88.00

α-(1-Methylethyl)-3-nitrobenzenepropanoic acid

  • CAS No. 858217-06-8

  • Cat. No. CS-0645270
  • Purity≥98%
  • MDL No.None

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

α-(1-Methylethyl)-3-nitrobenzenepropanoic acid|CS-0645270

Structure of 858217-06-8

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General Information

  • CAS No. 858217-06-8
  • Cat. No. CS-0645270
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₁₅NO₄
  • Molecular Weight 237.25
  • Synonym(s) None
  • SMILES O=C(C(C(C)C)CC1=CC(N(=O)=O)=CC=C1)O

Safety Information

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GHS Pictogram : N/A
GHS No : N/A
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   80.44
  • LogP   2.4941
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   5

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