Home Halogens 4,6-dichloro-3-hydroxy-2-nitrobenzoic acid

4,6-dichloro-3-hydroxy-2-nitrobenzoic acid

CAS No.:
253268-25-6
Catalog Number:
AG01DHPO
Molecular Formula:
C7H3Cl2NO5
Molecular Weight:
252.0084
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Product Description
Catalog Number:
AG01DHPO
Chemical Name:
4,6-dichloro-3-hydroxy-2-nitrobenzoic acid
CAS Number:
253268-25-6
Molecular Formula:
C7H3Cl2NO5
Molecular Weight:
252.0084
MDL Number:
MFCD25961548
IUPAC Name:
4,6-dichloro-3-hydroxy-2-nitrobenzoic acid
InChI:
InChI=1S/C7H3Cl2NO5/c8-2-1-3(9)6(11)5(10(14)15)4(2)7(12)13/h1,11H,(H,12,13)
InChI Key:
WKTGFYBNDVOWML-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C(=O)O)c(Cl)cc(c1O)Cl
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.939g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
252.003g/mol
Monoisotopic Mass:
250.939g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties