Home Boronic acids 1-N-Ethoxycarbonyl-indazole-5-boronic acid pinacol ester

1-N-Ethoxycarbonyl-indazole-5-boronic acid pinacol ester

CAS No.:
947191-19-7
Catalog Number:
AG00IIH2
Molecular Formula:
C16H21BN2O4
Molecular Weight:
316.1599
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$438
- +
5g
95%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00IIH2
Chemical Name:
1-N-Ethoxycarbonyl-indazole-5-boronic acid pinacol ester
CAS Number:
947191-19-7
Molecular Formula:
C16H21BN2O4
Molecular Weight:
316.1599
MDL Number:
MFCD25541763
IUPAC Name:
ethyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole-3-carboxylate
InChI:
InChI=1S/C16H21BN2O4/c1-6-21-14(20)13-11-9-10(7-8-12(11)18-19-13)17-22-15(2,3)16(4,5)23-17/h7-9H,6H2,1-5H3,(H,18,19)
InChI Key:
WGBOIRLHBDFLAS-UHFFFAOYSA-N
SMILES:
CCOC(=O)n1ncc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
455  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
316.159g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
316.164g/mol
Monoisotopic Mass:
316.159g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
73.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties