1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-

Base Information

• Chemical Name: 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-
• CAS No.: 14576-21-7
• Molecular Formula: C11H10N2O4
• Molecular Weight: 234.211
• DSSTox Substance ID: DTXSID70446496
• Wikidata: Q82265152
• Mol file: 14576-21-7.mol

Synonyms:14576-21-7;1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-;4,4-dimethyl-7-nitroisoquinoline-1,3(2h,4h)-dione;4,4-dimethyl-7-nitroisoquinoline-1,3-dione;SCHEMBL5823105;DTXSID70446496;IJRTYXJAHMLEJN-UHFFFAOYSA-N;WS-02951;D86141;4,4-dimethyl-7-nitroisoquinoline-1,3 (2H,4H)-dione;4,4-dimethyl-7-nitro-1,2,3,4-tetrahydroisoquinoline-1,3-dione

Chemical Property of 1,3(2H,4H)-Isoquinolinedione, 4,4-dimethyl-7-nitro-

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 234.06405680
• Heavy Atom Count: 17
• Complexity: 385

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1(C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC1=O)C