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150490-94-1 | 2,5-Piperazinedione, 1-(1-hydroxyethyl)-
CAS No: 150490-94-1 Catalog No: AG001MNE MDL No:
Product Description
Catalog Number:
AG001MNE
Chemical Name:
2,5-Piperazinedione, 1-(1-hydroxyethyl)-
CAS Number:
150490-94-1
Molecular Formula:
C6H10N2O3
Molecular Weight:
158.1552
IUPAC Name:
1-(1-hydroxyethyl)piperazine-2,5-dione
InChI:
InChI=1S/C6H10N2O3/c1-4(9)8-3-5(10)7-2-6(8)11/h4,9H,2-3H2,1H3,(H,7,10)
InChI Key:
KUEOKSQVFLNFKK-UHFFFAOYSA-N
SMILES:
O=C1NCC(=O)N(C1)C(O)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.069g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
158.157g/mol
Monoisotopic Mass:
158.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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