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Home > Boronic Acids > 945041-98-5
945041-98-5 | 2-Trifluoromethoxy-4-formyl-phenyl boronic acid
CAS No: 945041-98-5 Catalog No: AG00IIB4 MDL No:
Product Description
Catalog Number:
AG00IIB4
Chemical Name:
2-Trifluoromethoxy-4-formyl-phenyl boronic acid
CAS Number:
945041-98-5
IUPAC Name:
[4-formyl-2-(trifluoromethoxy)phenyl]boronic acid
InChI:
InChI=1S/C8H6BF3O4/c10-8(11,12)16-7-3-5(4-13)1-2-6(7)9(14)15/h1-4,14-15H
InChI Key:
QZYRPZPLLTUBDU-UHFFFAOYSA-N
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.031g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
233.937g/mol
Monoisotopic Mass:
234.031g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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