Home Boronic acids {2-[3-(trifluoromethyl)phenyl]ethenyl}boronic acid

{2-[3-(trifluoromethyl)phenyl]ethenyl}boronic acid

CAS No.:
698998-84-4
Catalog Number:
AG00G1ZC
Molecular Formula:
C9H8BF3O2
Molecular Weight:
215.9648
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00G1ZC
Chemical Name:
{2-[3-(trifluoromethyl)phenyl]ethenyl}boronic acid
CAS Number:
698998-84-4
Molecular Formula:
C9H8BF3O2
Molecular Weight:
215.9648
MDL Number:
MFCD05865156
IUPAC Name:
[(E)-2-[3-(trifluoromethyl)phenyl]ethenyl]boronic acid
InChI:
InChI=1S/C9H8BF3O2/c11-9(12,13)8-3-1-2-7(6-8)4-5-10(14)15/h1-6,14-15H/b5-4+
InChI Key:
HGEVMEKGPYPLRD-SNAWJCMRSA-N
SMILES:
OB(C=Cc1cccc(c1)C(F)(F)F)O
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
216.057g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
215.966g/mol
Monoisotopic Mass:
216.057g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties