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Home > Other Heterocycles > 241813-08-1
241813-08-1 | 1-Azabicyclo[5.2.0]non-4-en-9-one
CAS No: 241813-08-1 Catalog No: AG006X63 MDL No:
Product Description
Catalog Number:
AG006X63
Chemical Name:
1-Azabicyclo[5.2.0]non-4-en-9-one
CAS Number:
241813-08-1
Molecular Formula:
C8H11NO
Molecular Weight:
137.1790
IUPAC Name:
1-azabicyclo[5.2.0]non-4-en-9-one
InChI:
InChI=1S/C8H11NO/c10-8-6-7-4-2-1-3-5-9(7)8/h1-2,7H,3-6H2
InChI Key:
FVLSPECQDJCCIR-UHFFFAOYSA-N
SMILES:
O=C1CC2N1CCC=CC2
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
137.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
137.182g/mol
Monoisotopic Mass:
137.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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