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Home > Other Heterocycles > 18955-78-7
18955-78-7 | Acetamide, N-1-azabicyclo[2.2.2]oct-4-yl-
CAS No: 18955-78-7 Catalog No: AG002DR3 MDL No:
Product Description
Catalog Number:
AG002DR3
Chemical Name:
Acetamide, N-1-azabicyclo[2.2.2]oct-4-yl-
CAS Number:
18955-78-7
Molecular Formula:
C9H16N2O
Molecular Weight:
168.2361
IUPAC Name:
N-(1-azabicyclo[2.2.2]octan-4-yl)acetamide
InChI:
InChI=1S/C9H16N2O/c1-8(12)10-9-2-5-11(6-3-9)7-4-9/h2-7H2,1H3,(H,10,12)
InChI Key:
QBBCDCAKMDTCPG-UHFFFAOYSA-N
SMILES:
CC(=O)NC12CCN(CC1)CC2
Properties
Complexity:
181
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:
0.1
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