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Home > Aldehydes > 197638-76-9
197638-76-9 | Benzaldehyde, 4-(4-ethyl-1-piperazinyl)-
CAS No: 197638-76-9 Catalog No: AG002AXQ MDL No:MFCD05864670
Product Description
Catalog Number:
AG002AXQ
Chemical Name:
Benzaldehyde, 4-(4-ethyl-1-piperazinyl)-
CAS Number:
197638-76-9
Molecular Formula:
C13H18N2O
Molecular Weight:
218.2948
MDL Number:
MFCD05864670
IUPAC Name:
4-(4-ethylpiperazin-1-yl)benzaldehyde
InChI:
InChI=1S/C13H18N2O/c1-2-14-7-9-15(10-8-14)13-5-3-12(11-16)4-6-13/h3-6,11H,2,7-10H2,1H3
InChI Key:
UXVDOPUAJVRFDG-UHFFFAOYSA-N
SMILES:
CCN1CCN(CC1)c1ccc(cc1)C=O
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.142g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.3g/mol
Monoisotopic Mass:
218.142g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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