Home Boronic acids 1-Boc-3,5-dimethylpyrazole-4-boronic acid pinacol ester

1-Boc-3,5-dimethylpyrazole-4-boronic acid pinacol ester

CAS No.:
1073354-70-7
Catalog Number:
AG003UJK
Molecular Formula:
C16H27BN2O4
Molecular Weight:
322.2076
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$58
- +
1g
98%
In Stock USA
United States
$119
- +
5g
98%
In Stock USA
United States
$475
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG003UJK
Chemical Name:
1-Boc-3,5-dimethylpyrazole-4-boronic acid pinacol ester
CAS Number:
1073354-70-7
Molecular Formula:
C16H27BN2O4
Molecular Weight:
322.2076
MDL Number:
MFCD09027070
IUPAC Name:
tert-butyl 3,5-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazole-1-carboxylate
InChI:
InChI=1S/C16H27BN2O4/c1-10-12(17-22-15(6,7)16(8,9)23-17)11(2)19(18-10)13(20)21-14(3,4)5/h1-9H3
InChI Key:
GNLNGVZPEKSDAR-UHFFFAOYSA-N
SMILES:
Cc1nn(c(c1B1OC(C(O1)(C)C)(C)C)C)C(=O)OC(C)(C)C
Properties
Complexity:
459  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.206g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.212g/mol
Monoisotopic Mass:
322.206g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties