Cas no 39510-88-8 (2-Methoxymethyl-1,4-naphthoquinone)

2-Methoxymethyl-1,4-naphthoquinone structure
39510-88-8 structure
Product Name:2-Methoxymethyl-1,4-naphthoquinone
CAS No:39510-88-8
MF:C12H10O3
MW:202.206003665924
CID:924648
PubChem ID:170217
Update Time:2025-04-19

2-Methoxymethyl-1,4-naphthoquinone Chemical and Physical Properties

Names and Identifiers

    • 2-Methoxymethyl-1,4-naphthoquinone
    • 1,4-naphthalenedione, 2-(methoxymethyl)-
    • 2-(Methoxymethyl)-1,4-naphthoquinone
    • 2-Mom-1,4-naphthoquinone
    • 2-Methoxymethyl-[1,4]naphthoquinone
    • 39510-88-8
    • SCHEMBL3272909
    • DTXSID60960136
    • CHEMBL163391
    • 2-(methoxymethyl)naphthalene-1,4-dione
    • Inchi: 1S/C12H10O3/c1-15-7-8-6-11(13)9-4-2-3-5-10(9)12(8)14/h2-6H,7H2,1H3
    • InChI Key: ISZFXJTUZRXWNR-UHFFFAOYSA-N
    • SMILES: O(C)CC1=CC(C2C=CC=CC=2C1=O)=O

Computed Properties

  • Exact Mass: 202.063
  • Monoisotopic Mass: 202.062994177g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 317
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.5
  • Topological Polar Surface Area: 43.4?2

Experimental Properties

  • PSA: 43.37
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