Home Halogens methyl 5-bromo-4-chloro-2-nitrobenzoate

methyl 5-bromo-4-chloro-2-nitrobenzoate

CAS No.:
1820703-50-1
Catalog Number:
AG00I0VX
Molecular Formula:
C8H5BrClNO4
Molecular Weight:
294.4866
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$563
- +
5g
98%
In Stock USA
United States
$1500
- +
Product Description
Catalog Number:
AG00I0VX
Chemical Name:
methyl 5-bromo-4-chloro-2-nitrobenzoate
CAS Number:
1820703-50-1
Molecular Formula:
C8H5BrClNO4
Molecular Weight:
294.4866
MDL Number:
MFCD27578411
IUPAC Name:
methyl 5-bromo-4-chloro-2-nitrobenzoate
InChI:
InChI=1S/C8H5BrClNO4/c1-15-8(12)4-2-5(9)6(10)3-7(4)11(13)14/h2-3H,1H3
InChI Key:
WKLIFCLIGLIUIB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(Br)c(cc1[N+](=O)[O-])Cl
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.909g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.485g/mol
Monoisotopic Mass:
292.909g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties