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71754-91-1 | 2,3-Piperazinedione,1-ethyl-6-methyl-, (6S)-
CAS No: 71754-91-1 Catalog No: AG005FM0 MDL No:
Product Description
Catalog Number:
AG005FM0
Chemical Name:
2,3-Piperazinedione,1-ethyl-6-methyl-, (6S)-
CAS Number:
71754-91-1
Molecular Formula:
C7H12N2O2
Molecular Weight:
156.1824
IUPAC Name:
(6S)-1-ethyl-6-methylpiperazine-2,3-dione
InChI:
InChI=1S/C7H12N2O2/c1-3-9-5(2)4-8-6(10)7(9)11/h5H,3-4H2,1-2H3,(H,8,10)/t5-/m0/s1
InChI Key:
KIXBEOPGNRUBRA-YFKPBYRVSA-N
SMILES:
CCN1[C@@H](C)CNC(=O)C1=O
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
156.09g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
156.185g/mol
Monoisotopic Mass:
156.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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