Home Boronic acids 3-(Tetrahydrofurfurylaminocarbonyl)phenylboronic acid pinacol ester

3-(Tetrahydrofurfurylaminocarbonyl)phenylboronic acid pinacol ester

CAS No.:
1073355-06-2
Catalog Number:
AG0090ES
Molecular Formula:
C18H26BNO4
Molecular Weight:
331.2143
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$37
- +
5g
96%
In Stock USA
United States
$113
- +
Product Description
Catalog Number:
AG0090ES
Chemical Name:
3-(Tetrahydrofurfurylaminocarbonyl)phenylboronic acid pinacol ester
CAS Number:
1073355-06-2
Molecular Formula:
C18H26BNO4
Molecular Weight:
331.2143
MDL Number:
MFCD09266189
IUPAC Name:
N-(oxolan-2-ylmethyl)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide
InChI:
InChI=1S/C18H26BNO4/c1-17(2)18(3,4)24-19(23-17)14-8-5-7-13(11-14)16(21)20-12-15-9-6-10-22-15/h5,7-8,11,15H,6,9-10,12H2,1-4H3,(H,20,21)
InChI Key:
KHXJYLFLGVPADA-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(c1)B1OC(C(O1)(C)C)(C)C)NCC1CCCO1
Properties
Complexity:
452  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
331.195g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
331.219g/mol
Monoisotopic Mass:
331.195g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
56.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties