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137066-48-9 | 2-Piperazinone, 4-(2-hydroxypropyl)-6-methyl-
CAS No: 137066-48-9 Catalog No: AG0012SW MDL No:
Product Description
Catalog Number:
AG0012SW
Chemical Name:
2-Piperazinone, 4-(2-hydroxypropyl)-6-methyl-
CAS Number:
137066-48-9
Molecular Formula:
C8H16N2O2
Molecular Weight:
172.2248
IUPAC Name:
4-(2-hydroxypropyl)-6-methylpiperazin-2-one
InChI:
InChI=1S/C8H16N2O2/c1-6-3-10(4-7(2)11)5-8(12)9-6/h6-7,11H,3-5H2,1-2H3,(H,9,12)
InChI Key:
YODCUAYVOVZAMQ-UHFFFAOYSA-N
SMILES:
CC(CN1CC(C)NC(=O)C1)O
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.121g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
172.228g/mol
Monoisotopic Mass:
172.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
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