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Home > Other Heterocycles > 88441-58-1
88441-58-1 | Spiro[4.11]hexadecan-1-one, 4-methylene-
CAS No: 88441-58-1 Catalog No: AG004JOL MDL No:
Product Description
Catalog Number:
AG004JOL
Chemical Name:
Spiro[4.11]hexadecan-1-one, 4-methylene-
CAS Number:
88441-58-1
Molecular Formula:
C17H28O
Molecular Weight:
248.4036
IUPAC Name:
1-methylidenespiro[4.11]hexadecan-4-one
InChI:
InChI=1S/C17H28O/c1-15-11-12-16(18)17(15)13-9-7-5-3-2-4-6-8-10-14-17/h1-14H2
InChI Key:
CPKJCYSITHHODX-UHFFFAOYSA-N
SMILES:
C=C1CCC(=O)C21CCCCCCCCCCC2
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.214g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.41g/mol
Monoisotopic Mass:
248.214g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
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