1,4-Dioxo-1,4-dihydronaphthalene-2-carboxylic acid

Base Information

• Chemical Name: 1,4-Dioxo-1,4-dihydronaphthalene-2-carboxylic acid
• CAS No.: 20962-84-9
• Molecular Formula: C11H6O4
• Molecular Weight: 202.166
• ChEMBL ID: CHEMBL2334454
• DSSTox Substance ID: DTXSID00590890
• Nikkaji Number: J20.877I
• Wikidata: Q27160091
• Mol file: 20962-84-9.mol

Synonyms:20962-84-9;2-carboxy-1,4-naphthoquinone;1,4-dioxo-1,4-dihydronaphthalene-2-carboxylic acid;CHEBI:88158;1,4-naphthoquinone-2-carboxylic acid;2-Naphthalenecarboxylic acid, 1,4-dihydro-1,4-dioxo-;1,4-DIOXONAPHTHALENE-2-CARBOXYLIC ACID;naphthoquinone carboxylic acid;1,4-Dioxo-2-naphthoic acid;SCHEMBL1243588;CHEMBL2334454;DTXSID00590890;C22039;Q27160091

Chemical Property of 1,4-Dioxo-1,4-dihydronaphthalene-2-carboxylic acid

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 202.02660867
• Heavy Atom Count: 15
• Complexity: 367

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C=C(C2=O)C(=O)O