200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1813554-40-3
1813554-40-3 | 1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]-
CAS No: 1813554-40-3 Catalog No: AG01FFYD MDL No:
Product Description
Catalog Number:
AG01FFYD
Chemical Name:
1,3,2-Dioxaborolane, 4,4,5,5-tetramethyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]-
CAS Number:
1813554-40-3
Molecular Formula:
C20H22BF3O3
Molecular Weight:
378.1931
IUPAC Name:
4,4,5,5-tetramethyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]-1,3,2-dioxaborolane
InChI:
InChI=1S/C20H22BF3O3/c1-18(2)19(3,4)27-21(26-18)16-9-11-17(12-10-16)25-13-14-5-7-15(8-6-14)20(22,23)24/h5-12H,13H2,1-4H3
InChI Key:
WWHKUPQIPGDPFH-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)COc1ccc(cc1)B1OC(C(O1)(C)C)(C)C)(F)F
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
378.161g/mol
Formal Charge:
0
Heavy Atom Count:
27
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
378.198g/mol
Monoisotopic Mass:
378.161g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
27.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.