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Home > Other Heterocycles > 68978-78-9
68978-78-9 | 1-oxaspiro[4.4]nonan-4-one
CAS No: 68978-78-9 Catalog No: AG01C9WG MDL No:MFCD24691906
Product Description
Catalog Number:
AG01C9WG
Chemical Name:
1-oxaspiro[4.4]nonan-4-one
CAS Number:
68978-78-9
Molecular Formula:
C8H12O2
Molecular Weight:
140.1797
MDL Number:
MFCD24691906
IUPAC Name:
1-oxaspiro[4.4]nonan-4-one
InChI:
InChI=1S/C8H12O2/c9-7-3-6-10-8(7)4-1-2-5-8/h1-6H2
InChI Key:
GMKYURFSZJFGRM-UHFFFAOYSA-N
SMILES:
O=C1CCOC21CCCC2
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:
0.7
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