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Home > Other Heterocycles > 168133-91-3
168133-91-3 | 1-Azaspiro[5.5]undecan-7-one, 1-(phenylmethyl)-
CAS No: 168133-91-3 Catalog No: AG001XUF MDL No:
Product Description
Catalog Number:
AG001XUF
Chemical Name:
1-Azaspiro[5.5]undecan-7-one, 1-(phenylmethyl)-
CAS Number:
168133-91-3
Molecular Formula:
C17H23NO
Molecular Weight:
257.3706
IUPAC Name:
1-benzyl-1-azaspiro[5.5]undecan-11-one
InChI:
InChI=1S/C17H23NO/c19-16-10-4-5-11-17(16)12-6-7-13-18(17)14-15-8-2-1-3-9-15/h1-3,8-9H,4-7,10-14H2
InChI Key:
ORLHDIGDNKGKLH-UHFFFAOYSA-N
SMILES:
O=C1CCCCC21CCCCN2Cc1ccccc1
Properties
Complexity:
321
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.178g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.377g/mol
Monoisotopic Mass:
257.178g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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