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

Methyl 4-bromo-5-fluoro-2-methylbenzoate

CAS No.:
1352889-89-4
Catalog Number:
AG01F31C
Molecular Formula:
C9H8BrFO2
Molecular Weight:
247.0610
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$316
- +
1g
98%
1 week
United States
$563
- +
Product Description
Catalog Number:
AG01F31C
Chemical Name:
Methyl 4-bromo-5-fluoro-2-methylbenzoate
CAS Number:
1352889-89-4
Molecular Formula:
C9H8BrFO2
Molecular Weight:
247.0610
MDL Number:
MFCD21602050
IUPAC Name:
methyl 4-bromo-5-fluoro-2-methylbenzoate
InChI:
InChI=1S/C9H8BrFO2/c1-5-3-7(10)8(11)4-6(5)9(12)13-2/h3-4H,1-2H3
InChI Key:
KVHVZAULIHMOLK-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(F)c(cc1C)Br
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.969g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.063g/mol
Monoisotopic Mass:
245.969g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties