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Home > Other Heterocycles > 197978-00-0
197978-00-0 | 3,6-Dioxa-1-azabicyclo[5.2.0]nonane (9CI)
CAS No: 197978-00-0 Catalog No: AG002B75 MDL No:
Product Description
Catalog Number:
AG002B75
Chemical Name:
3,6-Dioxa-1-azabicyclo[5.2.0]nonane (9CI)
CAS Number:
197978-00-0
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
IUPAC Name:
3,6-dioxa-1-azabicyclo[5.2.0]nonane
InChI:
InChI=1S/C6H11NO2/c1-2-7-5-8-3-4-9-6(1)7/h6H,1-5H2
InChI Key:
JITGAWYCAXNYFP-UHFFFAOYSA-N
SMILES:
C1COC2N(CO1)CC2
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
129.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
129.159g/mol
Monoisotopic Mass:
129.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
21.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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