Home Boronic acids 3-[N-Cyclopropyl-N-(4-methoxybenzyl)sulfamoyl]phenylboronic acid

3-[N-Cyclopropyl-N-(4-methoxybenzyl)sulfamoyl]phenylboronic acid

CAS No.:
913836-07-4
Catalog Number:
AG006N8Q
Molecular Formula:
C17H20BNO5S
Molecular Weight:
361.2204
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
25g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG006N8Q
Chemical Name:
3-[N-Cyclopropyl-N-(4-methoxybenzyl)sulfamoyl]phenylboronic acid
CAS Number:
913836-07-4
Molecular Formula:
C17H20BNO5S
Molecular Weight:
361.2204
MDL Number:
MFCD09027233
IUPAC Name:
[3-[cyclopropyl-[(4-methoxyphenyl)methyl]sulfamoyl]phenyl]boronic acid
InChI:
InChI=1S/C17H20BNO5S/c1-24-16-9-5-13(6-10-16)12-19(15-7-8-15)25(22,23)17-4-2-3-14(11-17)18(20)21/h2-6,9-11,15,20-21H,7-8,12H2,1H3
InChI Key:
SEQRSOGIBTXUHT-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CN(S(=O)(=O)c1cccc(c1)B(O)O)C1CC1
Properties
Complexity:
526  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.116g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
361.219g/mol
Monoisotopic Mass:
361.116g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties