Home Boronic acids [5-(trifluoromethyl)furan-2-yl]boronic acid

[5-(trifluoromethyl)furan-2-yl]boronic acid

CAS No.:
1308354-99-5
Catalog Number:
AG01B5GZ
Molecular Formula:
C5H4BF3O3
Molecular Weight:
179.8897
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Product Description
Catalog Number:
AG01B5GZ
Chemical Name:
[5-(trifluoromethyl)furan-2-yl]boronic acid
CAS Number:
1308354-99-5
Molecular Formula:
C5H4BF3O3
Molecular Weight:
179.8897
MDL Number:
MFCD11501285
IUPAC Name:
[5-(trifluoromethyl)furan-2-yl]boronic acid
InChI:
InChI=1S/C5H4BF3O3/c7-5(8,9)3-1-2-4(12-3)6(10)11/h1-2,10-11H
InChI Key:
MSIFJTBEYRENGU-UHFFFAOYSA-N
SMILES:
OB(c1ccc(o1)C(F)(F)F)O
Properties
Complexity:
161  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.021g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
179.889g/mol
Monoisotopic Mass:
180.021g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties