1-Benzoxepine-4-carboxylic acid

Base Information

• Chemical Name: 1-Benzoxepine-4-carboxylic acid
• CAS No.: 923169-40-8
• Molecular Formula: C11H8O3
• Molecular Weight: 188.18
• European Community (EC) Number: 878-019-6
• Mol file: 923169-40-8.mol

Synonyms:1-benzoxepine-4-carboxylic acid;923169-40-8;benzo[b]oxepine-4-carboxylic acid;F3215-0254;SCHEMBL2336494;benzo[b]oxepine-4-carboxylicacid;MFCD08541457;AKOS002314191;CCG-310084;BS-18967;VU0513364-1;E78618;EN300-148758

Chemical Property of 1-Benzoxepine-4-carboxylic acid

Chemical Property:

• PKA: 3.00±0.20(Predicted)
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 188.047344113
• Heavy Atom Count: 14
• Complexity: 291

Purity/Quality:

NLT 98% ^*data from raw suppliers

1-Benzoxepine-4-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C=C(C=CO2)C(=O)O