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Home Nitros 4-Chloro-2-methoxy-5-nitro-benzoic acid

4-Chloro-2-methoxy-5-nitro-benzoic acid

CAS No.:
68255-77-6
Catalog Number:
AG006CYP
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$75
- +
5g
98%
In Stock USA
United States
$163
- +
10g
98%
In Stock USA
United States
$294
- +
25g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG006CYP
Chemical Name:
4-Chloro-2-methoxy-5-nitro-benzoic acid
CAS Number:
68255-77-6
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
MDL Number:
MFCD16873038
IUPAC Name:
4-chloro-2-methoxy-5-nitrobenzoic acid
InChI:
InChI=1S/C8H6ClNO5/c1-15-7-3-5(9)6(10(13)14)2-4(7)8(11)12/h2-3H,1H3,(H,11,12)
InChI Key:
RSBXOVZBSUWTCT-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)c(cc1C(=O)O)[N+](=O)[O-]
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
230.993g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
231.588g/mol
Monoisotopic Mass:
230.993g/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