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Home > Other Heterocycles > 68235-18-7
68235-18-7 | 2-oxa-4-azabicyclo[3.2.0]heptan-3-one
CAS No: 68235-18-7 Catalog No: AG01A53Y MDL No:MFCD19219146
Product Description
Catalog Number:
AG01A53Y
Chemical Name:
2-oxa-4-azabicyclo[3.2.0]heptan-3-one
CAS Number:
68235-18-7
Molecular Formula:
C5H7NO2
Molecular Weight:
113.1146
MDL Number:
MFCD19219146
IUPAC Name:
2-oxa-4-azabicyclo[3.2.0]heptan-3-one
InChI:
InChI=1S/C5H7NO2/c7-5-6-3-1-2-4(3)8-5/h3-4H,1-2H2,(H,6,7)
InChI Key:
SWPHEDFPEADJIA-UHFFFAOYSA-N
SMILES:
O=C1OC2C(N1)CC2
Properties
Complexity:
134
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
113.048g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
113.116g/mol
Monoisotopic Mass:
113.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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