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Home Boronic acids 4-(2-Carboxyethyl)phenylboronic acid

4-(2-Carboxyethyl)phenylboronic acid

CAS No.:
166316-48-9
Catalog Number:
AG001WN1
Molecular Formula:
C9H11BO4
Molecular Weight:
193.9922
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$73
- +
5g
98%
In Stock USA
United States
$289
- +
Product Description
Catalog Number:
AG001WN1
Chemical Name:
4-(2-Carboxyethyl)phenylboronic acid
CAS Number:
166316-48-9
Molecular Formula:
C9H11BO4
Molecular Weight:
193.9922
MDL Number:
MFCD01318119
IUPAC Name:
3-(4-boronophenyl)propanoic acid
InChI:
InChI=1S/C9H11BO4/c11-9(12)6-3-7-1-4-8(5-2-7)10(13)14/h1-2,4-5,13-14H,3,6H2,(H,11,12)
InChI Key:
VPSARXNVXCRDIV-UHFFFAOYSA-N
SMILES:
OC(=O)CCc1ccc(cc1)B(O)O
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.075g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
193.993g/mol
Monoisotopic Mass:
194.075g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
Title Journal
Biological evaluation of dopamine analogues containing phenylboronic acid group as new boron carriers. Applied radiation and isotopes : including data, instrumentation and methods for use in agriculture, industry and medicine 20111201
Phenylboronic-acid-based carbohydrate binders as antiviral therapeutics: monophenylboronic acids. Antiviral chemistry & chemotherapy 20100811
Properties