Home Boronic acids 1-(Methoxycarbonylmethyl)pyrazole-4-boronic acid pinacol ester

1-(Methoxycarbonylmethyl)pyrazole-4-boronic acid pinacol ester

CAS No.:
959585-44-5
Catalog Number:
AG00IJOE
Molecular Formula:
C12H19BN2O4
Molecular Weight:
266.1013
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$75
- +
1g
95%
In Stock USA
United States
$188
- +
5g
95%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00IJOE
Chemical Name:
1-(Methoxycarbonylmethyl)pyrazole-4-boronic acid pinacol ester
CAS Number:
959585-44-5
Molecular Formula:
C12H19BN2O4
Molecular Weight:
266.1013
MDL Number:
MFCD16660239
IUPAC Name:
methyl 2-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrazol-1-yl]acetate
InChI:
InChI=1S/C12H19BN2O4/c1-11(2)12(3,4)19-13(18-11)9-6-14-15(7-9)8-10(16)17-5/h6-7H,8H2,1-5H3
InChI Key:
WNEGZRZFYCBUGX-UHFFFAOYSA-N
SMILES:
COC(=O)Cn1ncc(c1)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
346  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
266.144g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
266.104g/mol
Monoisotopic Mass:
266.144g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties