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CS-W001157 4
Total: USD 88.00

1,3-Difluoro-5-nitrobenzene

  • CAS No. 2265-94-3

  • Cat. No. CS-W016187
  • Purity≥98%
  • MDL No.MFCD00012142

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

1,3-Difluoro-5-nitrobenzene|CS-W016187

Structure of 2265-94-3

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General Information

  • CAS No. 2265-94-3
  • Cat. No. CS-W016187
  • Purity ≥98%
  • MDL No. MFCD00012142
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₃F₂NO₂
  • Molecular Weight 159.09
  • Synonym(s) 3,5-Difluoronitrobenzene
  • SMILES FC1=CC(F)=CC([N+]([O-])=O)=C1

Description

Molecular structure of 3,5-difluoronitrobenzene was studied by gas-phase electron diffraction, MP2 ab initio and by B3LYP density functional calculations.

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 : H227-H315-H319-H335
Precautionary Statements : P210-P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P370+P378-P403-P405-P501

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Computational Chemistry Data

  • TPSA   43.14
  • LogP   1.873
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   1

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