Cas no 59824-69-0 (2H-3,1-Benzoxazine-2,4(1H)-dione, 1,6-dimethyl-)

2H-3,1-Benzoxazine-2,4(1H)-dione, 1,6-dimethyl- structure
59824-69-0 structure
Product Name:2H-3,1-Benzoxazine-2,4(1H)-dione, 1,6-dimethyl-
CAS No:59824-69-0
MF:C10H9NO3
MW:191.183362722397
CID:337196
PubChem ID:12369457
Update Time:2025-04-19

2H-3,1-Benzoxazine-2,4(1H)-dione, 1,6-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • 2H-3,1-Benzoxazine-2,4(1H)-dione, 1,6-dimethyl-
    • 1,6-DIMETHYL-1H-BENZO[D][1,3]OXAZINE-2,4-DIONE
    • 1,6-dimethyl-3,1-benzoxazine-2,4-dione
    • 1,6-Dimethyl-2H-3,1-benzoxazine-2,4(1H)-dione
    • N,5-Dimethylisatoic Anhydride
    • CS-0292206
    • Z111834192
    • XTEVRJNKYYTSLF-UHFFFAOYSA-N
    • 1,6-Dimethyl-2h-benzo[d][1,3]oxazine-2,4(1h)-dione
    • N-methyl-5-methylisatoic anhydride
    • 1, 6-Dimethyl-1H-benzo[d][1,3]oxazine-2,4-dione
    • 59824-69-0
    • SCHEMBL5525919
    • AKOS000275351
    • 1,6-dimethyl-1H-3,1-benzoxazine-2,4-dione
    • Inchi: 1S/C10H9NO3/c1-6-3-4-8-7(5-6)9(12)14-10(13)11(8)2/h3-5H,1-2H3
    • InChI Key: XTEVRJNKYYTSLF-UHFFFAOYSA-N
    • SMILES: O1C(N(C)C2C=CC(C)=CC=2C1=O)=O

Computed Properties

  • Exact Mass: 191.05827
  • Monoisotopic Mass: 191.058243149g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 277
  • 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: 1.6
  • Topological Polar Surface Area: 46.6?2

Experimental Properties

  • Density: 1.294±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 166-169 oC
  • Solubility: Slightly soluble (1.2 g/l) (25 o C),
  • PSA: 46.61
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