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Home > Other Heterocycles > 181-29-3
181-29-3 | 6-Azoniaspiro[5.6]dodecane (8CI,9CI)
CAS No: 181-29-3 Catalog No: AG0022J4 MDL No:
Product Description
Catalog Number:
AG0022J4
Chemical Name:
6-Azoniaspiro[5.6]dodecane (8CI,9CI)
CAS Number:
181-29-3
Molecular Formula:
C11H22N+
Molecular Weight:
168.2991
IUPAC Name:
6-azoniaspiro[5.6]dodecane
InChI:
InChI=1S/C11H22N/c1-2-5-9-12(8-4-1)10-6-3-7-11-12/h1-11H2/q+1
InChI Key:
HRRGWUPDHSNXDY-UHFFFAOYSA-N
SMILES:
C1CC[N+]2(CC1)CCCCCC2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.175g/mol
Formal Charge:
1
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.304g/mol
Monoisotopic Mass:
168.175g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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