1,4-Benzodioxin-2-carboxylic acid

Base Information

• Chemical Name: 1,4-Benzodioxin-2-carboxylic acid
• CAS No.: 67471-01-6
• Molecular Formula: C9H6O4
• Molecular Weight: 178.144
• DSSTox Substance ID: DTXSID30440677
• Nikkaji Number: J1.090.155C
• Mol file: 67471-01-6.mol

Synonyms:1,4-Benzodioxin-2-carboxylic acid;67471-01-6;1,4-benzodioxine-2-carboxylic acid;1,4-benzodioxine-3-carboxylic acid;Benzo[b][1,4]dioxine-2-carboxylic acid;SCHEMBL4204148;DTXSID30440677;ROTKCPXNSAQNCI-UHFFFAOYSA-N;AKOS006286278;Benzo[b][1,4]dioxine-2-carboxylicacid;EN300-190980

Chemical Property of 1,4-Benzodioxin-2-carboxylic acid

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 178.02660867
• Heavy Atom Count: 13
• Complexity: 246

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)OC=C(O2)C(=O)O