Home Halogens Methyl 2-bromo-3-nitrobenzoate

Methyl 2-bromo-3-nitrobenzoate

CAS No.:
5337-09-7
Catalog Number:
AG0039VH
Molecular Formula:
C8H6BrNO4
Molecular Weight:
260.0415
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$63
- +
5g
98%
In Stock USA
United States
$188
- +
10g
98%
In Stock USA
United States
$300
- +
25g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG0039VH
Chemical Name:
Methyl 2-bromo-3-nitrobenzoate
CAS Number:
5337-09-7
Molecular Formula:
C8H6BrNO4
Molecular Weight:
260.0415
MDL Number:
MFCD00087891
IUPAC Name:
methyl 2-bromo-3-nitrobenzoate
InChI:
InChI=1S/C8H6BrNO4/c1-14-8(11)5-3-2-4-6(7(5)9)10(12)13/h2-4H,1H3
InChI Key:
YUWPKYJCYRFBJT-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1Br)[N+](=O)[O-]
Properties
Complexity:
240  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.948g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.043g/mol
Monoisotopic Mass:
258.948g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties