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Home > Other Heterocycles > 2060039-42-9
2060039-42-9 | 4-(2-methylphenyl)-2-azaspiro[4.4]nonan-1-one
CAS No: 2060039-42-9 Catalog No: AG01BZV6 MDL No:MFCD30486886
Product Description
Catalog Number:
AG01BZV6
Chemical Name:
4-(2-methylphenyl)-2-azaspiro[4.4]nonan-1-one
CAS Number:
2060039-42-9
Molecular Formula:
C15H19NO
Molecular Weight:
229.3175
MDL Number:
MFCD30486886
IUPAC Name:
4-(2-methylphenyl)-2-azaspiro[4.4]nonan-1-one
InChI:
InChI=1S/C15H19NO/c1-11-6-2-3-7-12(11)13-10-16-14(17)15(13)8-4-5-9-15/h2-3,6-7,13H,4-5,8-10H2,1H3,(H,16,17)
InChI Key:
BNGRKWCEYZTBRP-UHFFFAOYSA-N
SMILES:
O=C1NCC(C21CCCC2)c1ccccc1C
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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