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Home > Other Heterocycles > 16317-23-0
16317-23-0 | Bicyclo[2.2.2]oct-2-ene-2-carboxamide
CAS No: 16317-23-0 Catalog No: AG001TUH MDL No:
Product Description
Catalog Number:
AG001TUH
Chemical Name:
Bicyclo[2.2.2]oct-2-ene-2-carboxamide
CAS Number:
16317-23-0
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
IUPAC Name:
bicyclo[2.2.2]oct-2-ene-2-carboxamide
InChI:
InChI=1S/C9H13NO/c10-9(11)8-5-6-1-3-7(8)4-2-6/h5-7H,1-4H2,(H2,10,11)
InChI Key:
WTJIGKFFVPSBOM-UHFFFAOYSA-N
SMILES:
NC(=O)C1=CC2CCC1CC2
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.1g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.209g/mol
Monoisotopic Mass:
151.1g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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