Home Carboxys 3-Pyrrolidinecarboxylic acid, 1-(2,5-dimethoxyphenyl)-5-oxo-

3-Pyrrolidinecarboxylic acid, 1-(2,5-dimethoxyphenyl)-5-oxo-

CAS No.:
63674-60-2
Catalog Number:
AG00IB93
Molecular Formula:
C13H15NO5
Molecular Weight:
265.2619
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Product Description
Catalog Number:
AG00IB93
Chemical Name:
3-Pyrrolidinecarboxylic acid, 1-(2,5-dimethoxyphenyl)-5-oxo-
CAS Number:
63674-60-2
Molecular Formula:
C13H15NO5
Molecular Weight:
265.2619
MDL Number:
MFCD03085152
IUPAC Name:
1-(2,5-dimethoxyphenyl)-5-oxopyrrolidine-3-carboxylic acid
InChI:
InChI=1S/C13H15NO5/c1-18-9-3-4-11(19-2)10(6-9)14-7-8(13(16)17)5-12(14)15/h3-4,6,8H,5,7H2,1-2H3,(H,16,17)
InChI Key:
FEEBSVLOWPYDKI-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1N1CC(CC1=O)C(=O)O)OC
Properties
Complexity:
359  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
265.095g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
265.265g/mol
Monoisotopic Mass:
265.095g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
76.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties