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Home > Other Heterocycles > 111689-29-3
111689-29-3 | Spiro[4.5]decan-2-one, 1-methylene-
CAS No: 111689-29-3 Catalog No: AG0079DK MDL No:
Product Description
Catalog Number:
AG0079DK
Chemical Name:
Spiro[4.5]decan-2-one, 1-methylene-
CAS Number:
111689-29-3
Molecular Formula:
C11H16O
Molecular Weight:
164.2441
IUPAC Name:
4-methylidenespiro[4.5]decan-3-one
InChI:
InChI=1S/C11H16O/c1-9-10(12)5-8-11(9)6-3-2-4-7-11/h1-8H2
InChI Key:
CUUYFDGXVSJPOZ-UHFFFAOYSA-N
SMILES:
O=C1CCC2(C1=C)CCCCC2
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.12g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.248g/mol
Monoisotopic Mass:
164.12g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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