200,000+ products from a single source!
sales@angenechem.com
Home > Other Heterocycles > 112611-32-2
112611-32-2 | 1-Azoniabicyclo[2.2.2]octane, 1-methyl-3-oxo-
CAS No: 112611-32-2 Catalog No: AG0079IQ MDL No:
Product Description
Catalog Number:
AG0079IQ
Chemical Name:
1-Azoniabicyclo[2.2.2]octane, 1-methyl-3-oxo-
CAS Number:
112611-32-2
Molecular Formula:
C8H14NO+
Molecular Weight:
140.2029
IUPAC Name:
1-methyl-1-azoniabicyclo[2.2.2]octan-3-one
InChI:
InChI=1S/C8H14NO/c1-9-4-2-7(3-5-9)8(10)6-9/h7H,2-6H2,1H3/q+1
InChI Key:
LXEGNZLCWBTDGZ-UHFFFAOYSA-N
SMILES:
O=C1C[N+]2(C)CCC1CC2
Properties
Complexity:
168
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.108g/mol
Formal Charge:
1
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
140.206g/mol
Monoisotopic Mass:
140.108g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Related Products
© 2019 Angene International Limited. All rights Reserved.