Home Boronic acids 4-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester

4-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester

CAS No.:
832114-06-4
Catalog Number:
AG008J1O
Molecular Formula:
C18H27BN2O3
Molecular Weight:
330.2296
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$48
- +
1g
98%
In Stock USA
United States
$62
- +
5g
98%
In Stock USA
United States
$213
- +
10g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG008J1O
Chemical Name:
4-(4-Methylpiperazine-1-carbonyl)phenylboronic acid, pinacol ester
CAS Number:
832114-06-4
Molecular Formula:
C18H27BN2O3
Molecular Weight:
330.2296
MDL Number:
MFCD05863914
IUPAC Name:
(4-methylpiperazin-1-yl)-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone
InChI:
InChI=1S/C18H27BN2O3/c1-17(2)18(3,4)24-19(23-17)15-8-6-14(7-9-15)16(22)21-12-10-20(5)11-13-21/h6-9H,10-13H2,1-5H3
InChI Key:
TXCDVBDHDQAWLR-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)C(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
451  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.211g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.235g/mol
Monoisotopic Mass:
330.211g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties