200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 138525-75-4
138525-75-4 | Boronic acid, [4-[2-(4-ethoxyphenyl)ethyl]-2,6-difluorophenyl]- (9CI)
CAS No: 138525-75-4 Catalog No: AG0019DF MDL No:
Product Description
Catalog Number:
AG0019DF
Chemical Name:
Boronic acid, [4-[2-(4-ethoxyphenyl)ethyl]-2,6-difluorophenyl]- (9CI)
CAS Number:
138525-75-4
Molecular Formula:
C16H17BF2O3
Molecular Weight:
306.1122
IUPAC Name:
[4-[2-(4-ethoxyphenyl)ethyl]-2,6-difluorophenyl]boronic acid
InChI:
InChI=1S/C16H17BF2O3/c1-2-22-13-7-5-11(6-8-13)3-4-12-9-14(18)16(17(20)21)15(19)10-12/h5-10,20-21H,2-4H2,1H3
InChI Key:
KWSKPCVSQYYICT-UHFFFAOYSA-N
SMILES:
CCOc1ccc(cc1)CCc1cc(F)c(c(c1)F)B(O)O
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
306.124g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
306.116g/mol
Monoisotopic Mass:
306.124g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
49.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.