Home Boronic acids 3-(Methoxycarbonyl)indole-5-boronic acid pinacol ester

3-(Methoxycarbonyl)indole-5-boronic acid pinacol ester

CAS No.:
1100052-63-8
Catalog Number:
AG00HBNM
Molecular Formula:
C16H20BNO4
Molecular Weight:
301.1453
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
In Stock USA
United States
$200
- +
250mg
97%
In Stock USA
United States
$407
- +
1g
97%
In Stock USA
United States
$813
- +
Product Description
Catalog Number:
AG00HBNM
Chemical Name:
3-(Methoxycarbonyl)indole-5-boronic acid pinacol ester
CAS Number:
1100052-63-8
Molecular Formula:
C16H20BNO4
Molecular Weight:
301.1453
MDL Number:
MFCD20486631
IUPAC Name:
methyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-3-carboxylate
InChI:
InChI=1S/C16H20BNO4/c1-15(2)16(3,4)22-17(21-15)10-6-7-13-11(8-10)12(9-18-13)14(19)20-5/h6-9,18H,1-5H3
InChI Key:
GBJXMSNMGSGQFL-UHFFFAOYSA-N
SMILES:
COC(=O)c1c[nH]c2c1cc(cc2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
437  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
301.149g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
301.149g/mol
Monoisotopic Mass:
301.149g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties