200,000+ products from a single source!
sales@angenechem.com
Home > Boronic Acids > 1257647-82-7
1257647-82-7 | 4H-1,3,6,2-Dioxazaborocine-4,8(5H)-dione, 2-(3-bromo-2-fluorophenyl)dihydro-6-methyl-
CAS No: 1257647-82-7 Catalog No: AG000ONQ MDL No:
Product Description
Catalog Number:
AG000ONQ
Chemical Name:
4H-1,3,6,2-Dioxazaborocine-4,8(5H)-dione, 2-(3-bromo-2-fluorophenyl)dihydro-6-methyl-
CAS Number:
1257647-82-7
Molecular Formula:
C11H10BBrFNO4
Molecular Weight:
329.9148
IUPAC Name:
2-(3-bromo-2-fluorophenyl)-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
InChI:
InChI=1S/C11H10BBrFNO4/c1-15-5-9(16)18-12(19-10(17)6-15)7-3-2-4-8(13)11(7)14/h2-4H,5-6H2,1H3
InChI Key:
POSHLJSRMPWZEE-UHFFFAOYSA-N
SMILES:
CN1CC(=O)OB(OC(=O)C1)c1cccc(c1F)Br
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.987g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
329.916g/mol
Monoisotopic Mass:
328.987g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.