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Home > Other Heterocycles > 5732-98-9
5732-98-9 | 2-oxaspiro[4.4]nonan-1-one
CAS No: 5732-98-9 Catalog No: AG01AD43 MDL No:MFCD25964832
Product Description
Catalog Number:
AG01AD43
Chemical Name:
2-oxaspiro[4.4]nonan-1-one
CAS Number:
5732-98-9
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
MDL Number:
MFCD25964832
IUPAC Name:
2-oxaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C8H12O2/c9-7-8(5-6-10-7)3-1-2-4-8/h1-6H2
InChI Key:
PBZONIMHAVOWHW-UHFFFAOYSA-N
SMILES:
O=C1OCCC21CCCC2
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.084g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.182g/mol
Monoisotopic Mass:
140.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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