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1128-77-4 | 3,9-Diazabicyclo[4.2.1]nonan-4-one,3,9-dimethyl-
CAS No: 1128-77-4 Catalog No: AG0078PZ MDL No:
Product Description
Catalog Number:
AG0078PZ
Chemical Name:
3,9-Diazabicyclo[4.2.1]nonan-4-one,3,9-dimethyl-
CAS Number:
1128-77-4
Molecular Formula:
C9H16N2O
Molecular Weight:
168.2361
IUPAC Name:
3,9-dimethyl-3,9-diazabicyclo[4.2.1]nonan-4-one
InChI:
InChI=1S/C9H16N2O/c1-10-6-8-4-3-7(11(8)2)5-9(10)12/h7-8H,3-6H2,1-2H3
InChI Key:
HNDXTHOYSWHZEI-UHFFFAOYSA-N
SMILES:
CN1C2CCC1CC(=O)N(C2)C
NSC Number:
135362
Properties
Complexity:
205
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.24g/mol
Monoisotopic Mass:
168.126g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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