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Home > Other Heterocycles > 1780204-21-8
1780204-21-8 | 1-{2,6-diazaspiro[3.5]nonan-2-yl}butan-1-one
CAS No: 1780204-21-8 Catalog No: AG01DQIC MDL No:MFCD31458356
Product Description
Catalog Number:
AG01DQIC
Chemical Name:
1-{2,6-diazaspiro[3.5]nonan-2-yl}butan-1-one
CAS Number:
1780204-21-8
Molecular Formula:
C11H20N2O
Molecular Weight:
196.2893
MDL Number:
MFCD31458356
IUPAC Name:
1-(2,8-diazaspiro[3.5]nonan-2-yl)butan-1-one
InChI:
InChI=1S/C11H20N2O/c1-2-4-10(14)13-8-11(9-13)5-3-6-12-7-11/h12H,2-9H2,1H3
InChI Key:
SQWDMAXBIUYZHS-UHFFFAOYSA-N
SMILES:
CCCC(=O)N1CC2(C1)CCCNC2
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.158g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.294g/mol
Monoisotopic Mass:
196.158g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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