Home Other Building Blocks 3-methylpiperazine-2,6-dione

3-methylpiperazine-2,6-dione

CAS No.:
1486801-78-8
Catalog Number:
AG01DYSV
Molecular Formula:
C5H8N2O2
Molecular Weight:
128.1292
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Product Description
Catalog Number:
AG01DYSV
Chemical Name:
3-methylpiperazine-2,6-dione
CAS Number:
1486801-78-8
Molecular Formula:
C5H8N2O2
Molecular Weight:
128.1292
MDL Number:
MFCD21683087
IUPAC Name:
3-methylpiperazine-2,6-dione
InChI:
InChI=1S/C5H8N2O2/c1-3-5(9)7-4(8)2-6-3/h3,6H,2H2,1H3,(H,7,8,9)
InChI Key:
XNJHLZCLSPEUJN-UHFFFAOYSA-N
SMILES:
O=C1CNC(C(=O)N1)C
Properties
Complexity:
155  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.059g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
128.131g/mol
Monoisotopic Mass:
128.059g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9  
Properties