Cas no 920504-10-5 (1,2-Diiodo-4-nitro-5-propoxybenzene)

1,2-Diiodo-4-nitro-5-propoxybenzene structure
920504-10-5 structure
Product Name:1,2-Diiodo-4-nitro-5-propoxybenzene
CAS No:920504-10-5
MF:C9H9I2NO3
MW:432.981607198715
CID:756692
Update Time:2023-08-03

1,2-Diiodo-4-nitro-5-propoxybenzene Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1,2-diiodo-4-nitro-5-propoxy-
    • 1,2-diiodo-4-nitro-5-propoxybenzene
    • 1,2-Diiodo-4-nitro-5-propoxybenzene
    • Inchi: 1S/C9H9I2NO3/c1-2-3-15-9-5-7(11)6(10)4-8(9)12(13)14/h4-5H,2-3H2,1H3
    • InChI Key: CQXINUDRNCUMJN-UHFFFAOYSA-N
    • SMILES: IC1C(=CC(=C(C=1)OCCC)[N+](=O)[O-])I

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 222
  • Topological Polar Surface Area: 55
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