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Home > Other Heterocycles > 199926-45-9
199926-45-9 | 1,4-Diazabicyclo[2.2.2]octan-2-one, 3,3,5,5-tetramethyl-
CAS No: 199926-45-9 Catalog No: AG002CGE MDL No:
Product Description
Catalog Number:
AG002CGE
Chemical Name:
1,4-Diazabicyclo[2.2.2]octan-2-one, 3,3,5,5-tetramethyl-
CAS Number:
199926-45-9
Molecular Formula:
C10H18N2O
Molecular Weight:
182.2627
IUPAC Name:
3,3,5,5-tetramethyl-1,4-diazabicyclo[2.2.2]octan-2-one
InChI:
InChI=1S/C10H18N2O/c1-9(2)7-11-5-6-12(9)10(3,4)8(11)13/h5-7H2,1-4H3
InChI Key:
CZOGCYMTUFEANY-UHFFFAOYSA-N
SMILES:
O=C1N2CCN(C1(C)C)C(C2)(C)C
Properties
Complexity:
258
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.142g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
182.267g/mol
Monoisotopic Mass:
182.142g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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