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Home > Boronic Acids > 870778-85-1
870778-85-1 | (2-Fluoro-3,5-diformylphenyl)boronic acid
CAS No: 870778-85-1 Catalog No: AG003H8N MDL No:MFCD08276764
Product Description
Catalog Number:
AG003H8N
Chemical Name:
(2-Fluoro-3,5-diformylphenyl)boronic acid
CAS Number:
870778-85-1
Molecular Formula:
C8H6BFO4
Molecular Weight:
195.9402
MDL Number:
MFCD08276764
IUPAC Name:
(2-fluoro-3,5-diformylphenyl)boronic acid
InChI:
InChI=1S/C8H6BFO4/c10-8-6(4-12)1-5(3-11)2-7(8)9(13)14/h1-4,13-14H
InChI Key:
KKXARFPYUGQNNK-UHFFFAOYSA-N
SMILES:
O=Cc1cc(C=O)c(c(c1)B(O)O)F
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.034g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
195.94g/mol
Monoisotopic Mass:
196.034g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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