Home Boronic acids 4-Chloro-3-(isopropylcarbamoyl)phenylboronic acid

4-Chloro-3-(isopropylcarbamoyl)phenylboronic acid

CAS No.:
871332-74-0
Catalog Number:
AG004KM8
Molecular Formula:
C10H13BClNO3
Molecular Weight:
241.4791
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG004KM8
Chemical Name:
4-Chloro-3-(isopropylcarbamoyl)phenylboronic acid
CAS Number:
871332-74-0
Molecular Formula:
C10H13BClNO3
Molecular Weight:
241.4791
MDL Number:
MFCD07783866
IUPAC Name:
[4-chloro-3-(propan-2-ylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C10H13BClNO3/c1-6(2)13-10(14)8-5-7(11(15)16)3-4-9(8)12/h3-6,15-16H,1-2H3,(H,13,14)
InChI Key:
NKQOXEAGRQNWHG-UHFFFAOYSA-N
SMILES:
OB(c1ccc(c(c1)C(=O)NC(C)C)Cl)O
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
241.068g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
241.478g/mol
Monoisotopic Mass:
241.068g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties