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Home > Aldehydes > 198271-58-8
198271-58-8 | Benzaldehyde, 3-[3-(4-methyl-1-piperazinyl)propoxy]-
CAS No: 198271-58-8 Catalog No: AG002BE8 MDL No:MFCD08691790
Product Description
Catalog Number:
AG002BE8
Chemical Name:
Benzaldehyde, 3-[3-(4-methyl-1-piperazinyl)propoxy]-
CAS Number:
198271-58-8
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
MDL Number:
MFCD08691790
IUPAC Name:
3-[3-(4-methylpiperazin-1-yl)propoxy]benzaldehyde
InChI:
InChI=1S/C15H22N2O2/c1-16-7-9-17(10-8-16)6-3-11-19-15-5-2-4-14(12-15)13-18/h2,4-5,12-13H,3,6-11H2,1H3
InChI Key:
LCHQOCXCTXNIOS-UHFFFAOYSA-N
SMILES:
O=Cc1cccc(c1)OCCCN1CCN(CC1)C
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.168g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.353g/mol
Monoisotopic Mass:
262.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
32.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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