Cas no 78508-71-1 (Methyl 1-Nitronaphthalene-2-carboxylate)

Methyl 1-Nitronaphthalene-2-carboxylate structure
78508-71-1 structure
Product Name:Methyl 1-Nitronaphthalene-2-carboxylate
CAS No:78508-71-1
MF:C12H9NO4
MW:231.204163312912
CID:2126407
Update Time:2025-10-05

Methyl 1-Nitronaphthalene-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • methyl 1-nitro-2-naphthoate
    • methyl 1-nitronaphthalene-2-carboxylate
    • 1-nitro-[2]naphthoic acid methyl ester
    • 2-Naphthalenecarboxylic acid, 1-nitro-, methyl ester
    • Methyl 1-Nitronaphthalene-2-carboxylate
    • Inchi: 1S/C12H9NO4/c1-17-12(14)10-7-6-8-4-2-3-5-9(8)11(10)13(15)16/h2-7H,1H3
    • InChI Key: JOBULQXHDUJYCX-UHFFFAOYSA-N
    • SMILES: O(C)C(C1=CC=C2C=CC=CC2=C1[N+](=O)[O-])=O

Computed Properties

  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 312
  • Topological Polar Surface Area: 72.1

Methyl 1-Nitronaphthalene-2-carboxylate Pricemore >>

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