Home Carboxys 1-(3-phenoxypropanoyl)piperidine-4-carboxylic acid

1-(3-phenoxypropanoyl)piperidine-4-carboxylic acid

CAS No.:
1017163-16-4
Catalog Number:
AG019VJH
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
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Product Description
Catalog Number:
AG019VJH
Chemical Name:
1-(3-phenoxypropanoyl)piperidine-4-carboxylic acid
CAS Number:
1017163-16-4
Molecular Formula:
C15H19NO4
Molecular Weight:
277.3157
MDL Number:
MFCD09809412
IUPAC Name:
1-(3-phenoxypropanoyl)piperidine-4-carboxylic acid
InChI:
InChI=1S/C15H19NO4/c17-14(8-11-20-13-4-2-1-3-5-13)16-9-6-12(7-10-16)15(18)19/h1-5,12H,6-11H2,(H,18,19)
InChI Key:
JMMLELDJZKYDMM-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)C(=O)O)CCOc1ccccc1
Properties
Complexity:
331  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.131g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
277.32g/mol
Monoisotopic Mass:
277.131g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
66.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties