Home Boronic acids 4-(3-Chloropropylcarbamoyl)phenylboronic acid

4-(3-Chloropropylcarbamoyl)phenylboronic acid

CAS No.:
874460-03-4
Catalog Number:
AG004KCA
Molecular Formula:
C10H13BClNO3
Molecular Weight:
241.4791
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$105
- +
5g
98%
In Stock USA
United States
$420
- +
Product Description
Catalog Number:
AG004KCA
Chemical Name:
4-(3-Chloropropylcarbamoyl)phenylboronic acid
CAS Number:
874460-03-4
Molecular Formula:
C10H13BClNO3
Molecular Weight:
241.4791
MDL Number:
MFCD08235077
IUPAC Name:
[4-(3-chloropropylcarbamoyl)phenyl]boronic acid
InChI:
InChI=1S/C10H13BClNO3/c12-6-1-7-13-10(14)8-2-4-9(5-3-8)11(15)16/h2-5,15-16H,1,6-7H2,(H,13,14)
InChI Key:
UYNOFJBHOAQAKS-UHFFFAOYSA-N
SMILES:
ClCCCNC(=O)c1ccc(cc1)B(O)O
Properties
Complexity:
220  
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:
5  
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties