Benzoic acid, 3-amino-2-chloro-


Chemical Name: Benzoic acid, 3-amino-2-chloro-
CAS Number: 108679-71-6
Product Number: AG007U4Z(AGN-PC-0JRH8C)
Synonyms:
MDL No:
Molecular Formula: C7H6ClNO2
Molecular Weight: 171.5810

Identification/Properties


Computed Properties
Molecular Weight:
171.58g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
171.009g/mol
Monoisotopic Mass:
171.009g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
163
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


Other Analytical Data


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