Home Carboxys 1-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylic acid

1-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylic acid

CAS No.:
1483768-62-2
Catalog Number:
AG01BBJY
Molecular Formula:
C13H15NO4
Molecular Weight:
249.2625
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Product Description
Catalog Number:
AG01BBJY
Chemical Name:
1-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylic acid
CAS Number:
1483768-62-2
Molecular Formula:
C13H15NO4
Molecular Weight:
249.2625
MDL Number:
MFCD17053891
IUPAC Name:
1-(2-methoxyphenyl)-6-oxopiperidine-3-carboxylic acid
InChI:
InChI=1S/C13H15NO4/c1-18-11-5-3-2-4-10(11)14-8-9(13(16)17)6-7-12(14)15/h2-5,9H,6-8H2,1H3,(H,16,17)
InChI Key:
IOPGLRDFNCXXJD-UHFFFAOYSA-N
SMILES:
COc1ccccc1N1CC(CCC1=O)C(=O)O
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.1g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.266g/mol
Monoisotopic Mass:
249.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties