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Home > Other Heterocycles > 116725-67-8
116725-67-8 | 2-Azaspiro[4.5]decan-3-one, 2-(phenylmethyl)-
CAS No: 116725-67-8 Catalog No: AG000D57 MDL No:
Product Description
Catalog Number:
AG000D57
Chemical Name:
2-Azaspiro[4.5]decan-3-one, 2-(phenylmethyl)-
CAS Number:
116725-67-8
Molecular Formula:
C16H21NO
Molecular Weight:
243.3440
IUPAC Name:
2-benzyl-2-azaspiro[4.5]decan-3-one
InChI:
InChI=1S/C16H21NO/c18-15-11-16(9-5-2-6-10-16)13-17(15)12-14-7-3-1-4-8-14/h1,3-4,7-8H,2,5-6,9-13H2
InChI Key:
VYCMUYACNRCBMG-UHFFFAOYSA-N
SMILES:
O=C1CC2(CN1Cc1ccccc1)CCCCC2
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.162g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.35g/mol
Monoisotopic Mass:
243.162g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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