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Home > Other Heterocycles > 1782276-05-4
1782276-05-4 | 1-{2,6-diazaspiro[3.4]octan-2-yl}propan-1-one
CAS No: 1782276-05-4 Catalog No: AG01C7EZ MDL No:MFCD31436017
Product Description
Catalog Number:
AG01C7EZ
Chemical Name:
1-{2,6-diazaspiro[3.4]octan-2-yl}propan-1-one
CAS Number:
1782276-05-4
Molecular Formula:
C9H16N2O
Molecular Weight:
168.2361
MDL Number:
MFCD31436017
IUPAC Name:
1-(2,7-diazaspiro[3.4]octan-2-yl)propan-1-one
InChI:
InChI=1S/C9H16N2O/c1-2-8(12)11-6-9(7-11)3-4-10-5-9/h10H,2-7H2,1H3
InChI Key:
IWQWRRVGDCXNBL-UHFFFAOYSA-N
SMILES:
CCC(=O)N1CC2(C1)CNCC2
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.126g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
168.24g/mol
Monoisotopic Mass:
168.126g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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