Cas no 18753-50-9 (a-methyl-5-nitro-2-Furanmethanol)

a-methyl-5-nitro-2-Furanmethanol structure
18753-50-9 structure
Product Name:a-methyl-5-nitro-2-Furanmethanol
CAS No:18753-50-9
MF:C6H7NO4
MW:157.124081850052
CID:123170
PubChem ID:13435931
Update Time:2025-04-18

a-methyl-5-nitro-2-Furanmethanol Chemical and Physical Properties

Names and Identifiers

    • a-methyl-5-nitro-2-Furanmethanol
    • 2-Furanmethanol, alpha-methyl-5-nitro- (9CI)
    • 2-Furanmethanol, a-methyl-5-nitro-
    • SCHEMBL6741018
    • 18753-50-9
    • 1-(5-nitrofuran-2-yl)ethanol
    • Inchi: 1S/C6H7NO4/c1-4(8)5-2-3-6(11-5)7(9)10/h2-4,8H,1H3
    • InChI Key: HYGBOXNOCHXRPO-UHFFFAOYSA-N
    • SMILES: O1C(=CC=C1C(C)O)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 157.03750770g/mol
  • Monoisotopic Mass: 157.03750770g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 155
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 79.2?2
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