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Home > Other Heterocycles > 278-52-4
278-52-4 | 1-Azabicyclo[4.2.0]octane
CAS No: 278-52-4 Catalog No: AG002US7 MDL No:
Product Description
Catalog Number:
AG002US7
Chemical Name:
1-Azabicyclo[4.2.0]octane
CAS Number:
278-52-4
Molecular Formula:
C7H13N
Molecular Weight:
111.1848
IUPAC Name:
1-azabicyclo[4.2.0]octane
InChI:
InChI=1S/C7H13N/c1-2-5-8-6-4-7(8)3-1/h7H,1-6H2
InChI Key:
JTATVNVLVDZAGB-UHFFFAOYSA-N
SMILES:
C1CCC2N(C1)CC2
Properties
Complexity:
90.4
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
111.105g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
111.188g/mol
Monoisotopic Mass:
111.105g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
Literature
| Title | Journal |
|---|---|
| Synthesis, computational study and glycosidase inhibitory activity of polyhydroxylated conidine alkaloids--a bicyclic iminosugar. | Organic & biomolecular chemistry 20100721 |
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