Home Boronic acids 3-Chloro-4-(N-ethylcarbamoyl)phenylboronic acid

3-Chloro-4-(N-ethylcarbamoyl)phenylboronic acid

CAS No.:
850589-40-1
Catalog Number:
AG004YHQ
Molecular Formula:
C9H11BClNO3
Molecular Weight:
227.4525
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$150
- +
5g
97%
In Stock USA
United States
$450
- +
10g
97%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG004YHQ
Chemical Name:
3-Chloro-4-(N-ethylcarbamoyl)phenylboronic acid
CAS Number:
850589-40-1
Molecular Formula:
C9H11BClNO3
Molecular Weight:
227.4525
MDL Number:
MFCD07363767
IUPAC Name:
[3-chloro-4-(ethylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C9H11BClNO3/c1-2-12-9(13)7-4-3-6(10(14)15)5-8(7)11/h3-5,14-15H,2H2,1H3,(H,12,13)
InChI Key:
HJDYETAQUCUPFP-UHFFFAOYSA-N
SMILES:
CCNC(=O)c1ccc(cc1Cl)B(O)O
Properties
Complexity:
227  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.052g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
227.451g/mol
Monoisotopic Mass:
227.052g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties