Benzoic acid, 2-amino-4-chloro-5-fluoro-


Chemical Name: Benzoic acid, 2-amino-4-chloro-5-fluoro-
CAS Number: 108288-16-0
Product Number: AG0083US(AGN-PC-002BHR)
Synonyms:
MDL No:
Molecular Formula: C7H5ClFNO2
Molecular Weight: 189.5715

Identification/Properties


Computed Properties
Molecular Weight:
189.57g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
188.999g/mol
Monoisotopic Mass:
188.999g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
190
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

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NMR Spectrum


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