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Home > Other Heterocycles > 7309-42-4
7309-42-4 | 9-Methyl-3,9-diazabicyclo[4.2.1]nonan-4-one
CAS No: 7309-42-4 Catalog No: AG005CIM MDL No:MFCD08693835
Product Description
Catalog Number:
AG005CIM
Chemical Name:
9-Methyl-3,9-diazabicyclo[4.2.1]nonan-4-one
CAS Number:
7309-42-4
Molecular Formula:
C8H14N2O
Molecular Weight:
154.2096
MDL Number:
MFCD08693835
IUPAC Name:
9-methyl-3,9-diazabicyclo[4.2.1]nonan-4-one
InChI:
InChI=1S/C8H14N2O/c1-10-6-2-3-7(10)5-9-8(11)4-6/h6-7H,2-5H2,1H3,(H,9,11)
InChI Key:
ZPLMTUXXQQUKDH-UHFFFAOYSA-N
SMILES:
O=C1NCC2N(C(C1)CC2)C
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.111g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
154.213g/mol
Monoisotopic Mass:
154.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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