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Home > Aldehydes > 883512-41-2
883512-41-2 | 4-(4-benzyl-1-piperazino)-3-fluoro-benzaldehyde
CAS No: 883512-41-2 Catalog No: AG0046UF MDL No:MFCD06656560
Product Description
Catalog Number:
AG0046UF
Chemical Name:
4-(4-benzyl-1-piperazino)-3-fluoro-benzaldehyde
CAS Number:
883512-41-2
Molecular Formula:
C18H19FN2O
Molecular Weight:
298.3547
MDL Number:
MFCD06656560
IUPAC Name:
4-(4-benzylpiperazin-1-yl)-3-fluorobenzaldehyde
InChI:
InChI=1S/C18H19FN2O/c19-17-12-16(14-22)6-7-18(17)21-10-8-20(9-11-21)13-15-4-2-1-3-5-15/h1-7,12,14H,8-11,13H2
InChI Key:
YCFZOGSISOTMKW-UHFFFAOYSA-N
SMILES:
O=Cc1ccc(c(c1)F)N1CCN(CC1)Cc1ccccc1
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.148g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.361g/mol
Monoisotopic Mass:
298.148g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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