Home Halogens Methyl 3-bromo-4-chlorobenzoate

Methyl 3-bromo-4-chlorobenzoate

CAS No.:
107947-17-1
Catalog Number:
AG00847L
Molecular Formula:
C8H6BrClO2
Molecular Weight:
249.4890
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$38
- +
5g
98%
In Stock USA
United States
$138
- +
25g
98%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG00847L
Chemical Name:
Methyl 3-bromo-4-chlorobenzoate
CAS Number:
107947-17-1
Molecular Formula:
C8H6BrClO2
Molecular Weight:
249.4890
MDL Number:
MFCD09751943
IUPAC Name:
methyl 3-bromo-4-chlorobenzoate
InChI:
InChI=1S/C8H6BrClO2/c1-12-8(11)5-2-3-7(10)6(9)4-5/h2-4H,1H3
InChI Key:
CLRJXWANIVYEHH-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccc(c(c1)Br)Cl
Properties
Complexity:
174  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.924g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.488g/mol
Monoisotopic Mass:
247.924g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  
Properties