sales@angenesci.com
Login | Register
logo
Structures Search
Home Boronic acids (2-Methoxy-5-((4-methylpiperidin-1-yl)sulfonyl)phenyl)boronic acid

(2-Methoxy-5-((4-methylpiperidin-1-yl)sulfonyl)phenyl)boronic acid

CAS No.:
1704080-74-9
Catalog Number:
AG01DTFK
Molecular Formula:
C13H20BNO5S
Molecular Weight:
313.1776
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DTFK
Chemical Name:
(2-Methoxy-5-((4-methylpiperidin-1-yl)sulfonyl)phenyl)boronic acid
CAS Number:
1704080-74-9
Molecular Formula:
C13H20BNO5S
Molecular Weight:
313.1776
MDL Number:
MFCD28400416
IUPAC Name:
[2-methoxy-5-(4-methylpiperidin-1-yl)sulfonylphenyl]boronic acid
InChI:
InChI=1S/C13H20BNO5S/c1-10-5-7-15(8-6-10)21(18,19)11-3-4-13(20-2)12(9-11)14(16)17/h3-4,9-10,16-17H,5-8H2,1-2H3
InChI Key:
OYYXPVOFAXQXHK-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1B(O)O)S(=O)(=O)N1CCC(CC1)C
Properties
Complexity:
430  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.116g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
313.175g/mol
Monoisotopic Mass:
313.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
95.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties