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CS-W001157 4
Total: USD 88.00

4-Methyl-6-nitrobenzo[d][1,3]dioxole-5-carboxylic acid

  • CAS No. 861588-35-4

  • Cat. No. CS-0456396
  • Purity≥98%
  • MDL No.None

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

4-Methyl-6-nitrobenzo[d][1,3]dioxole-5-carboxylic acid|CS-0456396

Structure of 861588-35-4

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General Information

  • CAS No. 861588-35-4
  • Cat. No. CS-0456396
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₇NO₆
  • Molecular Weight 225.15
  • Synonym(s) 4-methyl-6-nitro-2H-1,3-benzodioxole-5-carboxylic acid
  • SMILES CC1=C(C(=CC2=C1OCO2)[N+](=O)[O-])C(=O)O

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317-H319
Precautionary Statements : P261-P264-P272-P280-P302+P352-P362+P364-P501

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Computational Chemistry Data

  • TPSA   98.9
  • LogP   1.33012
  • H_Acceptors   5
  • H_Donors   1
  • Rotatable_Bonds   2

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