200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 874460-07-8
874460-07-8 | 4-(4-Pyridylcarbamoyl)benzeneboronic acid
CAS No: 874460-07-8 Catalog No: AG01DTQS MDL No:
Product Description
Catalog Number:
AG01DTQS
Chemical Name:
4-(4-Pyridylcarbamoyl)benzeneboronic acid
CAS Number:
874460-07-8
Molecular Formula:
C12H11BN2O3
Molecular Weight:
242.0383
IUPAC Name:
[4-(pyridin-4-ylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C12H11BN2O3/c16-12(15-11-5-7-14-8-6-11)9-1-3-10(4-2-9)13(17)18/h1-8,17-18H,(H,14,15,16)
InChI Key:
DLAXOQCAZJZZCD-UHFFFAOYSA-N
SMILES:
OB(c1ccc(cc1)C(=O)Nc1ccncc1)O
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.086g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
242.041g/mol
Monoisotopic Mass:
242.086g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.