200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 958451-97-3
958451-97-3 | 4-(4-FLUORO-BUTYLSULFANYL)-BENZENEBORONIC ACID
CAS No: 958451-97-3 Catalog No: AG005X0E MDL No:
Product Description
Catalog Number:
AG005X0E
Chemical Name:
4-(4-FLUORO-BUTYLSULFANYL)-BENZENEBORONIC ACID
CAS Number:
958451-97-3
Molecular Formula:
C10H14BFO2S
Molecular Weight:
228.0914
IUPAC Name:
[4-(4-fluorobutylsulfanyl)phenyl]boronic acid
InChI:
InChI=1S/C10H14BFO2S/c12-7-1-2-8-15-10-5-3-9(4-6-10)11(13)14/h3-6,13-14H,1-2,7-8H2
InChI Key:
IVVHXSWZYXQHDY-UHFFFAOYSA-N
SMILES:
FCCCCSc1ccc(cc1)B(O)O
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.079g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
228.088g/mol
Monoisotopic Mass:
228.079g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
65.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.