Home Halogens 1-[3-(4-chlorophenyl)prop-2-enoyl]piperidine-2-carboxylic acid

1-[3-(4-chlorophenyl)prop-2-enoyl]piperidine-2-carboxylic acid

CAS No.:
1103961-49-4
Catalog Number:
AG019WY7
Molecular Formula:
C15H16ClNO3
Molecular Weight:
293.7454
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Product Description
Catalog Number:
AG019WY7
Chemical Name:
1-[3-(4-chlorophenyl)prop-2-enoyl]piperidine-2-carboxylic acid
CAS Number:
1103961-49-4
Molecular Formula:
C15H16ClNO3
Molecular Weight:
293.7454
MDL Number:
MFCD09934104
IUPAC Name:
1-[3-(4-chlorophenyl)prop-2-enoyl]piperidine-2-carboxylic acid
InChI:
InChI=1S/C15H16ClNO3/c16-12-7-4-11(5-8-12)6-9-14(18)17-10-2-1-3-13(17)15(19)20/h4-9,13H,1-3,10H2,(H,19,20)
InChI Key:
FAWKEDOABDTXJB-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCCCN1C(=O)C=Cc1ccc(cc1)Cl
Properties
Complexity:
389  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.082g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
293.747g/mol
Monoisotopic Mass:
293.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
57.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.9  
Properties