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Home > Aldehydes > 120014-29-1
120014-29-1 | 4-Piperidinecarboxaldehyde, 1-benzoyl-
CAS No: 120014-29-1 Catalog No: AG000Q3K MDL No:
Product Description
Catalog Number:
AG000Q3K
Chemical Name:
4-Piperidinecarboxaldehyde, 1-benzoyl-
CAS Number:
120014-29-1
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
IUPAC Name:
1-benzoylpiperidine-4-carbaldehyde
InChI:
InChI=1S/C13H15NO2/c15-10-11-6-8-14(9-7-11)13(16)12-4-2-1-3-5-12/h1-5,10-11H,6-9H2
InChI Key:
FXFCQBKRSKWLPE-UHFFFAOYSA-N
SMILES:
O=CC1CCN(CC1)C(=O)c1ccccc1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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