Cas no 14576-21-7 (4,4-dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione)

4,4-dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione structure
14576-21-7 structure
Product Name:4,4-dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione
CAS No:14576-21-7
MF:C11H10N2O4
MW:234.208102703094
CID:96582
PubChem ID:10868210
Update Time:2025-04-18

4,4-dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione Chemical and Physical Properties

Names and Identifiers

    • 4,4-dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione
    • 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
    • 4,4-dimethyl-7-nitroisoquinoline-1,3-dione
    • WS-02951
    • 14576-21-7
    • 4,4-dimethyl-7-nitro-1,2,3,4-tetrahydroisoquinoline-1,3-dione
    • SCHEMBL5823105
    • D86141
    • DTXSID70446496
    • SY267769
    • MFCD12912111
    • IJRTYXJAHMLEJN-UHFFFAOYSA-N
    • 4,4-dimethyl-7-nitroisoquinoline-1,3 (2H,4H)-dione
    • 4,4-DIMETHYL-7-NITRO-2H-ISOQUINOLINE-1,3-DIONE
    • Inchi： 1S/C11H10N2O4/c1-11(2)8-4-3-6(13(16)17)5-7(8)9(14)12-10(11)15/h3-5H,1-2H3,(H,12,14,15)
    • InChI Key： IJRTYXJAHMLEJN-UHFFFAOYSA-N
    • SMILES： O=C1C(C)(C)C2C=CC(=CC=2C(N1)=O)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 234.0641
  • Monoisotopic Mass: 234.06405680g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 0
  • Complexity: 385
  • 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: 1.4
  • Topological Polar Surface Area: 92?2

Experimental Properties

  • PSA: 89.31

4,4-dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
eNovation Chemicals LLC
Y1244647-500mg
1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
 14576-21-7 95%
500mg
 $540 2023-09-04
eNovation Chemicals LLC
Y1244647-100mg
1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
 14576-21-7 95%
100mg
 $110 2024-06-08
eNovation Chemicals LLC
Y1244647-250mg
1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
 14576-21-7 95%
250mg
 $150 2024-06-08
eNovation Chemicals LLC
Y1244647-1g
1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
 14576-21-7 95%
1g
 $760 2023-09-04
eNovation Chemicals LLC
Y1244647-5g
1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
 14576-21-7 95%
5g
 $2435 2023-09-04
abcr
AB591635-100mg
4,4-Dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione; .
 14576-21-7
100mg
 €342.90 2024-07-24
abcr
AB591635-250mg
4,4-Dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione; .
 14576-21-7
250mg
 €599.20 2024-07-24
abcr
AB591635-500mg
4,4-Dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione; .
 14576-21-7
500mg
 €293.20 2025-04-20
abcr
AB591635-1g
4,4-Dimethyl-7-nitroisoquinoline-1,3(2H,4H)-dione; .
 14576-21-7
1g
 €418.70 2025-04-20
eNovation Chemicals LLC
Y1244647-5g
1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
 14576-21-7 95%
5g
 $1310 2025-02-26

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