2-[3-(pyrrolidine-1-carbonyl)phenyl]benzoic acid


Chemical Name: 2-[3-(pyrrolidine-1-carbonyl)phenyl]benzoic acid
CAS Number: 1261941-65-4
Product Number: AG000S6Z(AGN-PC-09Q0I0)
Synonyms:
MDL No:
Molecular Formula: C18H17NO3
Molecular Weight: 295.3325

Identification/Properties


Computed Properties
Molecular Weight:
295.338g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
295.121g/mol
Monoisotopic Mass:
295.121g/mol
Topological Polar Surface Area:
57.6A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
417
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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