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Home > Other Heterocycles > 321351-72-8
321351-72-8 | 7-oxa-3-azabicyclo[4.2.0]octane
CAS No: 321351-72-8 Catalog No: AG01BHHY MDL No:MFCD28139637
Product Description
Catalog Number:
AG01BHHY
Chemical Name:
7-oxa-3-azabicyclo[4.2.0]octane
CAS Number:
321351-72-8
Molecular Formula:
C6H11NO
Molecular Weight:
113.1576
MDL Number:
MFCD28139637
IUPAC Name:
7-oxa-3-azabicyclo[4.2.0]octane
InChI:
InChI=1S/C6H11NO/c1-2-7-3-5-4-8-6(1)5/h5-7H,1-4H2
InChI Key:
PYESHYUOWMGQTR-UHFFFAOYSA-N
SMILES:
C1NCC2C(C1)OC2
Properties
Complexity:
94.5
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.084g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
113.16g/mol
Monoisotopic Mass:
113.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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