Home Other Building Blocks 3-phenyl-1-(piperazin-1-yl)butan-1-one

3-phenyl-1-(piperazin-1-yl)butan-1-one

CAS No.:
926206-96-4
Catalog Number:
AG019WM2
Molecular Formula:
C14H20N2O
Molecular Weight:
232.3214
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Product Description
Catalog Number:
AG019WM2
Chemical Name:
3-phenyl-1-(piperazin-1-yl)butan-1-one
CAS Number:
926206-96-4
Molecular Formula:
C14H20N2O
Molecular Weight:
232.3214
MDL Number:
MFCD08443255
IUPAC Name:
3-phenyl-1-piperazin-1-ylbutan-1-one
InChI:
InChI=1S/C14H20N2O/c1-12(13-5-3-2-4-6-13)11-14(17)16-9-7-15-8-10-16/h2-6,12,15H,7-11H2,1H3
InChI Key:
LZJGMEGORFZXAZ-UHFFFAOYSA-N
SMILES:
CC(c1ccccc1)CC(=O)N1CCNCC1
Properties
Complexity:
243  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.158g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
232.327g/mol
Monoisotopic Mass:
232.158g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties