Home Halogens Methyl 5-bromo-4-fluoro-2-hydroxybenzoate

Methyl 5-bromo-4-fluoro-2-hydroxybenzoate

CAS No.:
4133-72-6
Catalog Number:
AG00CLCI
Molecular Formula:
C8H6BrFO3
Molecular Weight:
249.0338
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$150
- +
1g
98%
In Stock USA
United States
$319
- +
5g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG00CLCI
Chemical Name:
Methyl 5-bromo-4-fluoro-2-hydroxybenzoate
CAS Number:
4133-72-6
Molecular Formula:
C8H6BrFO3
Molecular Weight:
249.0338
MDL Number:
MFCD27939807
IUPAC Name:
methyl 5-bromo-4-fluoro-2-hydroxybenzoate
InChI:
InChI=1S/C8H6BrFO3/c1-13-8(12)4-2-5(9)6(10)3-7(4)11/h2-3,11H,1H3
InChI Key:
MCMGUPTVQMMNDL-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Br)c(cc1O)F
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.948g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.035g/mol
Monoisotopic Mass:
247.948g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8  
Properties