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10338-57-5

10338-57-5 | 4-(Piperidin-1-yl)benzaldehyde

CAS No: 10338-57-5 Catalog No: AG00381S MDL No:MFCD00778395

Product Description

Catalog Number:
AG00381S
Chemical Name:
4-(Piperidin-1-yl)benzaldehyde
CAS Number:
10338-57-5
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD00778395
IUPAC Name:
4-piperidin-1-ylbenzaldehyde
InChI:
InChI=1S/C12H15NO/c14-10-11-4-6-12(7-5-11)13-8-2-1-3-9-13/h4-7,10H,1-3,8-9H2
InChI Key:
ILJVPSVCFVQUAD-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(cc1)N1CCCCC1
NSC Number:
156549

Properties

Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  

Literature

Title Journal
(E)-2-[4-(Piperidin-1-yl)benzyl-idene]-2,3-dihydro-1H-inden-1-one. Acta crystallographica. Section E, Structure reports online 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Synthesis, receptor potency, and selectivity of halogenated diphenylpiperidines as serotonin 5-HT2A ligands for PET or SPECT brain imaging. Journal of medicinal chemistry 20020523

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