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16350-43-9 | 2,5-Piperazinedione, 1-propyl-
CAS No: 16350-43-9 Catalog No: AG001U6O MDL No:
Product Description
Catalog Number:
AG001U6O
Chemical Name:
2,5-Piperazinedione, 1-propyl-
CAS Number:
16350-43-9
Molecular Formula:
C7H12N2O2
Molecular Weight:
156.1824
IUPAC Name:
5-methylidene-1-propylpiperazin-2-one
InChI:
InChI=1S/C8H14N2O/c1-3-4-10-6-7(2)9-5-8(10)11/h9H,2-6H2,1H3
InChI Key:
NWUFVBKVTQJHGL-UHFFFAOYSA-N
SMILES:
CCCN1CC(=O)NCC1=O
Properties
Complexity:
177
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.111g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.213g/mol
Monoisotopic Mass:
154.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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