200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 871332-65-9
871332-65-9 | (4-Chloro-3-(methylcarbamoyl)phenyl)boronic acid
CAS No: 871332-65-9 Catalog No: AG0036DC MDL No:MFCD07363795
Product Description
Catalog Number:
AG0036DC
Chemical Name:
(4-Chloro-3-(methylcarbamoyl)phenyl)boronic acid
CAS Number:
871332-65-9
Molecular Formula:
C8H9BClNO3
Molecular Weight:
213.4260
MDL Number:
MFCD07363795
IUPAC Name:
[4-chloro-3-(methylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C8H9BClNO3/c1-11-8(12)6-4-5(9(13)14)2-3-7(6)10/h2-4,13-14H,1H3,(H,11,12)
InChI Key:
SYZZWFMATUWETK-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cc(ccc1Cl)B(O)O
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.036g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
213.424g/mol
Monoisotopic Mass:
213.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
© 2019 Angene International Limited. All rights Reserved.