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113714-62-8 | 2(1H)-Quinoxalinone, octahydro-1,3,3-trimethyl-
CAS No: 113714-62-8 Catalog No: AG0009FN MDL No:
Product Description
Catalog Number:
AG0009FN
Chemical Name:
2(1H)-Quinoxalinone, octahydro-1,3,3-trimethyl-
CAS Number:
113714-62-8
Molecular Formula:
C11H20N2O
Molecular Weight:
196.2893
IUPAC Name:
1,3,3-trimethyl-4a,5,6,7,8,8a-hexahydro-4H-quinoxalin-2-one
InChI:
InChI=1S/C11H20N2O/c1-11(2)10(14)13(3)9-7-5-4-6-8(9)12-11/h8-9,12H,4-7H2,1-3H3
InChI Key:
SWKSAGOLKLVZFN-UHFFFAOYSA-N
SMILES:
CN1C2CCCCC2NC(C1=O)(C)C
Properties
Complexity:
250
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.158g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.294g/mol
Monoisotopic Mass:
196.158g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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