2-(2-Boronophenyl)acetic acid

Base Information

• Chemical Name: 2-(2-Boronophenyl)acetic acid
• CAS No.: 1001108-64-0
• Molecular Formula: C8H9BO4
• Molecular Weight: 179.96566
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID00681515
• Wikidata: Q82605583
• Mol file: 1001108-64-0.mol

Synonyms:2-(2-Boronophenyl)acetic acid;1001108-64-0;2-(CARBOXYMETHYL)PHENYLBORONIC ACID;2-[2-(dihydroxyboranyl)phenyl]acetic acid;2-(2-Boronophenyl)aceticacid;(2-Boronophenyl)acetic acid;SCHEMBL2558811;DTXSID00681515;ZWCYROWFNLFPED-UHFFFAOYSA-N;BQB10864;MFCD08704668;2-(carboxymethyl)-phenyl boronic acid;AKOS006291039;BS-19005

Chemical Property of 2-(2-Boronophenyl)acetic acid

Chemical Property:

• Boiling Point: 433.1±47.0 °C(Predicted)
• PKA: 4.33±0.10(Predicted)
• PSA: 77.76000
• Density: 1.33±0.1 g/cm3(Predicted)
• LogP: -1.00650
• Storage Temp.: Refrigerated.
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 180.0593889
• Heavy Atom Count: 13
• Complexity: 183

Purity/Quality:

97% ^*data from raw suppliers

2-(Carboxymethyl)phenylboronicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC=CC=C1CC(=O)O)(O)O
• Uses: 2-(Carboxymethyl)phenylboronic acid