Home Other Building Blocks 3-(3-methylphenyl)piperazin-2-one

3-(3-methylphenyl)piperazin-2-one

CAS No.:
1246555-04-3
Catalog Number:
AG01AC3E
Molecular Formula:
C11H14N2O
Molecular Weight:
190.2417
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Product Description
Catalog Number:
AG01AC3E
Chemical Name:
3-(3-methylphenyl)piperazin-2-one
CAS Number:
1246555-04-3
Molecular Formula:
C11H14N2O
Molecular Weight:
190.2417
MDL Number:
MFCD07373555
IUPAC Name:
3-(3-methylphenyl)piperazin-2-one
InChI:
InChI=1S/C11H14N2O/c1-8-3-2-4-9(7-8)10-11(14)13-6-5-12-10/h2-4,7,10,12H,5-6H2,1H3,(H,13,14)
InChI Key:
ICJMNPIQRKAJNV-UHFFFAOYSA-N
SMILES:
O=C1NCCNC1c1cccc(c1)C
Properties
Complexity:
217  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.111g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
190.246g/mol
Monoisotopic Mass:
190.111g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties