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

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

CAS No.:
33458-99-0
Catalog Number:
AG00CLCZ
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$250
- +
1g
95%
In Stock USA
United States
$563
- +
5g
95%
In Stock USA
United States
$2025
- +
Product Description
Catalog Number:
AG00CLCZ
Chemical Name:
2-Chloro-4-methoxy-5-nitro-benzoic acid
CAS Number:
33458-99-0
Molecular Formula:
C8H6ClNO5
Molecular Weight:
231.5899
MDL Number:
MFCD26395064
IUPAC Name:
2-chloro-4-methoxy-5-nitrobenzoic acid
InChI:
InChI=1S/C8H6ClNO5/c1-15-7-3-5(9)4(8(11)12)2-6(7)10(13)14/h2-3H,1H3,(H,11,12)
InChI Key:
WDHCRWZNSBIWKL-UHFFFAOYSA-N
SMILES:
COc1cc(Cl)c(cc1[N+](=O)[O-])C(=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