200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1005009-96-0
1005009-96-0 | 1,3,2-Dioxaborolane, 2-[4-methoxy-3-(trifluoromethoxy)phenyl]-4,4,5,5-tetramethyl-
CAS No: 1005009-96-0 Catalog No: AG01EQKH MDL No:
Product Description
Catalog Number:
AG01EQKH
Chemical Name:
1,3,2-Dioxaborolane, 2-[4-methoxy-3-(trifluoromethoxy)phenyl]-4,4,5,5-tetramethyl-
CAS Number:
1005009-96-0
Molecular Formula:
C14H18BF3O4
Molecular Weight:
318.0965
IUPAC Name:
2-[4-methoxy-3-(trifluoromethoxy)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
InChI:
InChI=1S/C14H18BF3O4/c1-12(2)13(3,4)22-15(21-12)9-6-7-10(19-5)11(8-9)20-14(16,17)18/h6-8H,1-5H3
InChI Key:
MPSGQKZFOMZHDM-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1OC(F)(F)F)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.125g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
318.099g/mol
Monoisotopic Mass:
318.125g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
36.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.