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6577-41-9 | Oxapium iodide
CAS No: 6577-41-9 Catalog No: AG00F9YB MDL No:MFCD00865243
Product Description
Catalog Number:
AG00F9YB
Chemical Name:
Oxapium iodide
CAS Number:
6577-41-9
MDL Number:
MFCD00865243
IUPAC Name:
1-[(2-cyclohexyl-2-phenyl-1,3-dioxolan-4-yl)methyl]-1-methylpiperidin-1-ium;iodide
InChI:
InChI=1S/C22H34NO2.HI/c1-23(15-9-4-10-16-23)17-21-18-24-22(25-21,19-11-5-2-6-12-19)20-13-7-3-8-14-20;/h2,5-6,11-12,20-21H,3-4,7-10,13-18H2,1H3;1H/q+1;/p-1
InChI Key:
YHEWVHONOOWLMW-UHFFFAOYSA-M
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
471.163g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
471.423g/mol
Monoisotopic Mass:
471.163g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
18.5A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
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