Home Other Building Blocks 3-[4-(trifluoromethyl)phenyl]piperazin-2-one

3-[4-(trifluoromethyl)phenyl]piperazin-2-one

CAS No.:
185110-29-6
Catalog Number:
AG01A30I
Molecular Formula:
C11H11F3N2O
Molecular Weight:
244.2130
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Product Description
Catalog Number:
AG01A30I
Chemical Name:
3-[4-(trifluoromethyl)phenyl]piperazin-2-one
CAS Number:
185110-29-6
Molecular Formula:
C11H11F3N2O
Molecular Weight:
244.2130
MDL Number:
MFCD07373603
IUPAC Name:
3-[4-(trifluoromethyl)phenyl]piperazin-2-one
InChI:
InChI=1S/C11H11F3N2O/c12-11(13,14)8-3-1-7(2-4-8)9-10(17)16-6-5-15-9/h1-4,9,15H,5-6H2,(H,16,17)
InChI Key:
RKKAPCSDNLGCTJ-UHFFFAOYSA-N
SMILES:
FC(c1ccc(cc1)C1NCCNC1=O)(F)F
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.082g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
244.217g/mol
Monoisotopic Mass:
244.082g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties