Home Halogens Methyl 5-bromo-2-methoxy-4-(trifluoromethyl)benzoate

Methyl 5-bromo-2-methoxy-4-(trifluoromethyl)benzoate

CAS No.:
1131587-97-7
Catalog Number:
AG008YBJ
Molecular Formula:
C10H8BrF3O3
Molecular Weight:
313.0679
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$463
- +
Product Description
Catalog Number:
AG008YBJ
Chemical Name:
Methyl 5-bromo-2-methoxy-4-(trifluoromethyl)benzoate
CAS Number:
1131587-97-7
Molecular Formula:
C10H8BrF3O3
Molecular Weight:
313.0679
MDL Number:
MFCD11110856
IUPAC Name:
methyl 5-bromo-2-methoxy-4-(trifluoromethyl)benzoate
InChI:
InChI=1S/C10H8BrF3O3/c1-16-8-4-6(10(12,13)14)7(11)3-5(8)9(15)17-2/h3-4H,1-2H3
InChI Key:
XVIIEWCHQVKVDM-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Br)c(cc1OC)C(F)(F)F
Properties
Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.961g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.07g/mol
Monoisotopic Mass:
311.961g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties