methyl 3-chloro-6-fluoro-2-nitrobenzoate


Chemical Name: methyl 3-chloro-6-fluoro-2-nitrobenzoate
CAS Number: 2102410-62-6
Product Number: AG01DKIA(AG01DKIA)
Synonyms:
MDL No:
Molecular Formula: C8H5ClFNO4
Molecular Weight: 233.5810

Identification/Properties


Computed Properties
Molecular Weight:
233.579g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
232.989g/mol
Monoisotopic Mass:
232.989g/mol
Topological Polar Surface Area:
72.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
270
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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