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18940-57-3 | Ethanone, 1,1'-(1,4-piperazinediyl)bis-
CAS No: 18940-57-3 Catalog No: AG002DNO MDL No:MFCD00456879
Product Description
Catalog Number:
AG002DNO
Chemical Name:
Ethanone, 1,1'-(1,4-piperazinediyl)bis-
CAS Number:
18940-57-3
Molecular Formula:
C8H14N2O2
Molecular Weight:
170.2090
MDL Number:
MFCD00456879
IUPAC Name:
1-(4-acetylpiperazin-1-yl)ethanone
InChI:
InChI=1S/C8H14N2O2/c1-7(11)9-3-5-10(6-4-9)8(2)12/h3-6H2,1-2H3
InChI Key:
NBQBICYRKOTWRR-UHFFFAOYSA-N
SMILES:
CC(=O)N1CCN(CC1)C(=O)C
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.106g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.212g/mol
Monoisotopic Mass:
170.106g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1
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