Home Nitros 6-Bromo-3-methoxy-2-nitrobenzoic acid

6-Bromo-3-methoxy-2-nitrobenzoic acid

CAS No.:
127971-97-5
Catalog Number:
AG000XMW
Molecular Formula:
C8H6BrNO5
Molecular Weight:
276.0409
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$144
- +
1g
95%
In Stock USA
United States
$363
- +
Product Description
Catalog Number:
AG000XMW
Chemical Name:
6-Bromo-3-methoxy-2-nitrobenzoic acid
CAS Number:
127971-97-5
Molecular Formula:
C8H6BrNO5
Molecular Weight:
276.0409
MDL Number:
MFCD14525762
IUPAC Name:
6-bromo-3-methoxy-2-nitrobenzoic acid
InChI:
InChI=1S/C8H6BrNO5/c1-15-5-3-2-4(9)6(8(11)12)7(5)10(13)14/h2-3H,1H3,(H,11,12)
InChI Key:
GDQNQIOGEJXLHT-UHFFFAOYSA-N
SMILES:
COc1ccc(c(c1[N+](=O)[O-])C(=O)O)Br
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.943g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
276.042g/mol
Monoisotopic Mass:
274.943g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties