1-(3-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid


Chemical Name: 1-(3-methylphenyl)-2-oxopyrrolidine-3-carboxylic acid
CAS Number: 618070-31-8
Product Number: AG00EIAU(AGN-PC-0LDJPW)
Synonyms:
MDL No:
Molecular Formula: C12H13NO3
Molecular Weight: 219.23652

Identification/Properties


Computed Properties
Molecular Weight:
219.24g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
219.09g/mol
Monoisotopic Mass:
219.09g/mol
Topological Polar Surface Area:
57.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
303
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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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