3-(pyrrolidin-1-ylmethyl)benzoic acid


Chemical Name: 3-(pyrrolidin-1-ylmethyl)benzoic acid
CAS Number: 884507-41-9
Product Number: AG019WBV(AGN-PC-015VH0)
Synonyms:
MDL No:
Molecular Formula: C12H15NO2
Molecular Weight: 205.2530

Identification/Properties


Computed Properties
Molecular Weight:
205.257g/mol
XLogP3:
-1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
205.11g/mol
Monoisotopic Mass:
205.11g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
224
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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