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Home > Other Heterocycles > 52978-85-5
52978-85-5 | 3-Methylene-1-oxaspiro[4.5]decan-2-one
CAS No: 52978-85-5 Catalog No: AG01FNQH MDL No:
Product Description
Catalog Number:
AG01FNQH
Chemical Name:
3-Methylene-1-oxaspiro[4.5]decan-2-one
CAS Number:
52978-85-5
Molecular Formula:
C10H14O2
Molecular Weight:
166.2170
IUPAC Name:
3-methylidene-1-oxaspiro[4.5]decan-2-one
InChI:
InChI=1S/C10H14O2/c1-8-7-10(12-9(8)11)5-3-2-4-6-10/h1-7H2
InChI Key:
IIBYNQIZDCDJIS-UHFFFAOYSA-N
SMILES:
C=C1CC2(OC1=O)CCCCC2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.099g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
166.22g/mol
Monoisotopic Mass:
166.099g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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