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Home > Other Heterocycles > 2059935-56-5
2059935-56-5 | 4-(3-methylphenyl)-2-azaspiro[4.4]nonan-1-one
CAS No: 2059935-56-5 Catalog No: AG01BZV9 MDL No:MFCD30486889
Product Description
Catalog Number:
AG01BZV9
Chemical Name:
4-(3-methylphenyl)-2-azaspiro[4.4]nonan-1-one
CAS Number:
2059935-56-5
Molecular Formula:
C15H19NO
Molecular Weight:
229.3175
MDL Number:
MFCD30486889
IUPAC Name:
4-(3-methylphenyl)-2-azaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C15H19NO/c1-11-5-4-6-12(9-11)13-10-16-14(17)15(13)7-2-3-8-15/h4-6,9,13H,2-3,7-8,10H2,1H3,(H,16,17)
InChI Key:
JECRSKQJXZIXFF-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C1CNC(=O)C21CCCC2
Properties
Complexity:
306
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.147g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.323g/mol
Monoisotopic Mass:
229.147g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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