Cas no 1216770-08-9 (Nabumetone-d3)

Nabumetone-d3 structure
Nabumetone-d3 structure
Product Name:Nabumetone-d3
CAS No:1216770-08-9
MF:C15H16O2
MW:231.304829597473
CID:1059994
PubChem ID:46782414
Update Time:2025-04-20

Nabumetone-d3 Chemical and Physical Properties

Names and Identifiers

    • Nabumetone-d3
    • 4-[6-(trideuteriomethoxy)naphthalen-2-yl]butan-2-one
    • Arthaxan-d3
    • Consolan-d3
    • Gambaran
    • Gambaran-d3
    • Nabumeton-d3
    • Nabuser-d3
    • Relafen-d3
    • Relifen-d3
    • Relifex-d3
    • Balmox-d3
    • Nabugesic 500
    • Nabugesic 500-d3
    • BRL 14777-d3
    • 1-(2'-Methoxynaphth-6'-yl)butan-3-one
    • 4-[6-(Methoxy-d3)-2-naphthyl]-2-butanone
    • 1-(2'-Methoxy-d3-naphth-6'-yl)butan-3-one
    • 4-[6-(Methoxy-d3)-2-naphthalenyl]-2-butanone
    • 4-{6-[(~2~H_3_)Methyloxy]naphthalen-2-yl}butan-2-one
    • DTXSID90676051
    • 1216770-08-9
    • F91176
    • Nabumetone-d3 (methoxy-d3)
    • CS-0169669
    • HY-B0559S
    • AKOS025311079
    • Inchi: 1S/C15H16O2/c1-11(16)3-4-12-5-6-14-10-15(17-2)8-7-13(14)9-12/h5-10H,3-4H2,1-2H3/i2D3
    • InChI Key: BLXXJMDCKKHMKV-BMSJAHLVSA-N
    • SMILES: O(C([2H])([2H])[2H])C1C=CC2C=C(C=CC=2C=1)CCC(C)=O

Computed Properties

  • Exact Mass: 231.13400
  • Monoisotopic Mass: 231.133859987g/mol
  • Isotope Atom Count: 3
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 262
  • 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: 3.1
  • Topological Polar Surface Area: 26.3

Experimental Properties

  • PSA: 26.30000
  • LogP: 3.37000

Nabumetone-d3 Pricemore >>

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