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1021240-06-1

1021240-06-1 | 2-(4-acetylpiperazin-1-yl)benzaldehyde

CAS No: 1021240-06-1 Catalog No: AG019WO0 MDL No:MFCD11156387

Product Description

Catalog Number:
AG019WO0
Chemical Name:
2-(4-acetylpiperazin-1-yl)benzaldehyde
CAS Number:
1021240-06-1
Molecular Formula:
C13H16N2O2
Molecular Weight:
232.2783
MDL Number:
MFCD11156387
IUPAC Name:
2-(4-acetylpiperazin-1-yl)benzaldehyde
InChI:
InChI=1S/C13H16N2O2/c1-11(17)14-6-8-15(9-7-14)13-5-3-2-4-12(13)10-16/h2-5,10H,6-9H2,1H3
InChI Key:
KFKXHZVBHCEHSS-UHFFFAOYSA-N
SMILES:
O=Cc1ccccc1N1CCN(CC1)C(=O)C

Properties

Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.121g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.283g/mol
Monoisotopic Mass:
232.121g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

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