Home Boronic acids 4-(1,3-Dimethyl-2,4,6-trioxohexahydropyrimidin-5-ylidenemethyl)benzeneboronic acid pinacol ester

4-(1,3-Dimethyl-2,4,6-trioxohexahydropyrimidin-5-ylidenemethyl)benzeneboronic acid pinacol ester

CAS No.:
1218790-48-7
Catalog Number:
AG009II5
Molecular Formula:
C19H23BN2O5
Molecular Weight:
370.2073
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$143
- +
250mg
95%
In Stock USA
United States
$223
- +
1g
95%
In Stock USA
United States
$483
- +
5g
95%
In Stock USA
United States
$1394
- +
Product Description
Catalog Number:
AG009II5
Chemical Name:
4-(1,3-Dimethyl-2,4,6-trioxohexahydropyrimidin-5-ylidenemethyl)benzeneboronic acid pinacol ester
CAS Number:
1218790-48-7
Molecular Formula:
C19H23BN2O5
Molecular Weight:
370.2073
MDL Number:
MFCD11113040
IUPAC Name:
1,3-dimethyl-5-[[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methylidene]-1,3-diazinane-2,4,6-trione
InChI:
InChI=1S/C19H23BN2O5/c1-18(2)19(3,4)27-20(26-18)13-9-7-12(8-10-13)11-14-15(23)21(5)17(25)22(6)16(14)24/h7-11H,1-6H3
InChI Key:
AWWSBYIWDATYAG-UHFFFAOYSA-N
SMILES:
CN1C(=O)N(C)C(=O)C(=Cc2ccc(cc2)B2OC(C(O2)(C)C)(C)C)C1=O
Properties
Complexity:
652  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.17g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.212g/mol
Monoisotopic Mass:
370.17g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties