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Home > Other Heterocycles > 699-61-6
699-61-6 | 1-Oxaspiro[4.5]decan-2-one
CAS No: 699-61-6 Catalog No: AG0036NM MDL No:
Product Description
Catalog Number:
AG0036NM
Chemical Name:
1-Oxaspiro[4.5]decan-2-one
CAS Number:
699-61-6
Molecular Formula:
C9H14O2
Molecular Weight:
154.2063
IUPAC Name:
1-oxaspiro[4.5]decan-2-one
InChI:
InChI=1S/C9H14O2/c10-8-4-7-9(11-8)5-2-1-3-6-9/h1-7H2
InChI Key:
QYNYVJFXPJUEMW-UHFFFAOYSA-N
SMILES:
O=C1CCC2(O1)CCCCC2
EC Number:
478-240-4
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.099g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
154.209g/mol
Monoisotopic Mass:
154.099g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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