Home Halogens 3,5-Dichloro-2-nitrobenzoic acid

3,5-Dichloro-2-nitrobenzoic acid

CAS No.:
23082-45-3
Catalog Number:
AG00BPNN
Molecular Formula:
C7H3Cl2NO4
Molecular Weight:
236.0090
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Product Description
Catalog Number:
AG00BPNN
Chemical Name:
3,5-Dichloro-2-nitrobenzoic acid
CAS Number:
23082-45-3
Molecular Formula:
C7H3Cl2NO4
Molecular Weight:
236.0090
MDL Number:
MFCD01098205
IUPAC Name:
3,5-dichloro-2-nitrobenzoic acid
InChI:
InChI=1S/C7H3Cl2NO4/c8-3-1-4(7(11)12)6(10(13)14)5(9)2-3/h1-2H,(H,11,12)
InChI Key:
LKMJMYZOEGSMDN-UHFFFAOYSA-N
SMILES:
Clc1cc(Cl)c(c(c1)C(=O)O)[N+](=O)[O-]
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.944g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.004g/mol
Monoisotopic Mass:
234.944g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties