3-(Cyclopropylaminocarbonyl)phenylboronic acid

Base Information

• Chemical Name: 3-(Cyclopropylaminocarbonyl)phenylboronic acid
• CAS No.: 850567-23-6
• Molecular Formula: C10H12BNO3
• Molecular Weight: 205.021
• Hs Code.: 2931900090
• European Community (EC) Number: 800-542-5
• DSSTox Substance ID: DTXSID80397682
• Wikidata: Q72460652
• Mol file: 850567-23-6.mol

Synonyms:850567-23-6;3-(Cyclopropylaminocarbonyl)phenylboronic acid;(3-(Cyclopropylcarbamoyl)phenyl)boronic acid;[3-(cyclopropylcarbamoyl)phenyl]boronic Acid;3-(CYCLOPROPYLCARBAMOYL)BENZENEBORONIC ACID;3-(cyclopropylcarbamoyl)phenylboronic acid;3-(Cyclopropylaminocarbonyl)benzeneboronic acid;FMOC-ISONIPECOTICACID;SCHEMBL148956;DTXSID80397682;ACYLEYDBPWXTIO-UHFFFAOYSA-N;STR09927;MFCD04115694;AKOS015840752;AB20418;CS-W013182;BP-10881;(3-(Cyclopropylcarbamoyl)phenyl)boronicacid;3-(cyclopropylcarbamoyl)phenyl boronic acid;FT-0764544;A22346;D71329;3-[(n-cyclopropyl)aminocarbonyl]phenylboronic acid;3-(cyclopropylaminocarbonyl)phenylboronic acid, AldrichCPR

Chemical Property of 3-(Cyclopropylaminocarbonyl)phenylboronic acid

Chemical Property:

• Appearance/Colour: White to light yellow crystal powder
• Melting Point: 220-226 °C
• Refractive Index: 1.586
• PKA: 7.86±0.10(Predicted)
• PSA: 69.56000
• Density: 1.28 g/cm³
• LogP: -0.35050
• Storage Temp.: Keep Cold
• Sensitive.: Moisture Sensitive
• Solubility.: DMSO (Sparingly, Sonicated), Methanol (Slightly)
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 205.0910234
• Heavy Atom Count: 15
• Complexity: 243

Purity/Quality:

97% ^*data from raw suppliers

3-(Cyclopropylcarbamoyl)phenylboronicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CC(=CC=C1)C(=O)NC2CC2)(O)O
• Uses: 3-(Cyclopropylcarbamoyl)phenylboronic Acid can be prepared as antibacterial agents.