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90058-23-4 | 1,4-Diazaspiro[5.5]undecane-2,5-dione, 3-methyl-, (S)-
CAS No: 90058-23-4 Catalog No: AG006KF6 MDL No:
Product Description
Catalog Number:
AG006KF6
Chemical Name:
1,4-Diazaspiro[5.5]undecane-2,5-dione, 3-methyl-, (S)-
CAS Number:
90058-23-4
Molecular Formula:
C10H16N2O2
Molecular Weight:
196.2462
IUPAC Name:
(3S)-3-methyl-1,4-diazaspiro[5.5]undecane-2,5-dione
InChI:
InChI=1S/C10H16N2O2/c1-7-8(13)12-10(9(14)11-7)5-3-2-4-6-10/h7H,2-6H2,1H3,(H,11,14)(H,12,13)/t7-/m0/s1
InChI Key:
QTRCQHLISNNBNQ-ZETCQYMHSA-N
SMILES:
C[C@@H]1NC(=O)C2(NC1=O)CCCCC2
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
196.121g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
196.25g/mol
Monoisotopic Mass:
196.121g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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