Home Other Building Blocks 4-Bromo-2-fluorophenol

4-Bromo-2-fluorophenol

CAS No.:
2105-94-4
Catalog Number:
AG002KUE
Molecular Formula:
C6H4BrFO
Molecular Weight:
190.9978
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$32
- +
100g
98%
In Stock USA
United States
$94
- +
500g
98%
In Stock USA
United States
$368
- +
Product Description
Catalog Number:
AG002KUE
Chemical Name:
4-Bromo-2-fluorophenol
CAS Number:
2105-94-4
Molecular Formula:
C6H4BrFO
Molecular Weight:
190.9978
MDL Number:
MFCD00011722
IUPAC Name:
4-bromo-2-fluorophenol
InChI:
InChI=1S/C6H4BrFO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H
InChI Key:
RYVOZMPTISNBDB-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1)F)O
Properties
Complexity:
99.1  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.943g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
190.999g/mol
Monoisotopic Mass:
189.943g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Literature
Title Journal
1hJFH coupling in 2-fluorophenol revisited: is intramolecular hydrogen bond responsible for this long-range coupling? Magnetic resonance in chemistry : MRC 20111201
Properties