Home Halogens Methyl 5-bromo-2-(difluoromethoxy)benzoate

Methyl 5-bromo-2-(difluoromethoxy)benzoate

CAS No.:
1131587-78-4
Catalog Number:
AG00940I
Molecular Formula:
C9H7BrF2O3
Molecular Weight:
281.0509
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$181
- +
5g
98%
In Stock USA
United States
$563
- +
10g
98%
In Stock USA
United States
$938
- +
Product Description
Catalog Number:
AG00940I
Chemical Name:
Methyl 5-bromo-2-(difluoromethoxy)benzoate
CAS Number:
1131587-78-4
Molecular Formula:
C9H7BrF2O3
Molecular Weight:
281.0509
MDL Number:
MFCD11110847
IUPAC Name:
methyl 5-bromo-2-(difluoromethoxy)benzoate
InChI:
InChI=1S/C9H7BrF2O3/c1-14-8(13)6-4-5(10)2-3-7(6)15-9(11)12/h2-4,9H,1H3
InChI Key:
UBPSOKPHMMEARW-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Br)ccc1OC(F)F
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.955g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.053g/mol
Monoisotopic Mass:
279.955g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties