Home Other Building Blocks 1-(4-fluorophenyl)-3,3-dimethylpiperazin-2-one

1-(4-fluorophenyl)-3,3-dimethylpiperazin-2-one

CAS No.:
1514610-57-1
Catalog Number:
AG01DVHL
Molecular Formula:
C12H15FN2O
Molecular Weight:
222.2587
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Product Description
Catalog Number:
AG01DVHL
Chemical Name:
1-(4-fluorophenyl)-3,3-dimethylpiperazin-2-one
CAS Number:
1514610-57-1
Molecular Formula:
C12H15FN2O
Molecular Weight:
222.2587
MDL Number:
MFCD26645753
IUPAC Name:
1-(4-fluorophenyl)-3,3-dimethylpiperazin-2-one
InChI:
InChI=1S/C12H15FN2O/c1-12(2)11(16)15(8-7-14-12)10-5-3-9(13)4-6-10/h3-6,14H,7-8H2,1-2H3
InChI Key:
CLLYMBGVWOUTQJ-UHFFFAOYSA-N
SMILES:
O=C1N(CCNC1(C)C)c1ccc(cc1)F
Properties
Complexity:
272  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.117g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.263g/mol
Monoisotopic Mass:
222.117g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties