Home Boronic acids 4-(4-Methylpiperazinocarbonyl)methylphenylboronic acid, pinacol ester

4-(4-Methylpiperazinocarbonyl)methylphenylboronic acid, pinacol ester

CAS No.:
1010104-30-9
Catalog Number:
AG00947X
Molecular Formula:
C19H29BN2O3
Molecular Weight:
344.2562
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$225
- +
1g
95%
In Stock USA
United States
$500
- +
Product Description
Catalog Number:
AG00947X
Chemical Name:
4-(4-Methylpiperazinocarbonyl)methylphenylboronic acid, pinacol ester
CAS Number:
1010104-30-9
Molecular Formula:
C19H29BN2O3
Molecular Weight:
344.2562
MDL Number:
MFCD18783186
IUPAC Name:
1-(4-methylpiperazin-1-yl)-2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]ethanone
InChI:
InChI=1S/C19H29BN2O3/c1-18(2)19(3,4)25-20(24-18)16-8-6-15(7-9-16)14-17(23)22-12-10-21(5)11-13-22/h6-9H,10-14H2,1-5H3
InChI Key:
CDLWYEGACFMAKG-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)C(=O)Cc1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
465  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
344.227g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.262g/mol
Monoisotopic Mass:
344.227g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties