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Home > Bromides > 1935441-96-5
1935441-96-5 | 5-Bromo-6-fluoroisatoic anhydride
CAS No: 1935441-96-5 Catalog No: AG01FH8B MDL No:
Product Description
Catalog Number:
AG01FH8B
Chemical Name:
5-Bromo-6-fluoroisatoic anhydride
CAS Number:
1935441-96-5
IUPAC Name:
6-bromo-5-fluoro-1H-3,1-benzoxazine-2,4-dione
InChI:
InChI=1S/C8H3BrFNO3/c9-3-1-2-4-5(6(3)10)7(12)14-8(13)11-4/h1-2H,(H,11,13)
InChI Key:
JTKVAZWAWDROOX-UHFFFAOYSA-N
Properties
Complexity:
286
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.928g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
260.018g/mol
Monoisotopic Mass:
258.928g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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