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89389-91-3 | Pyridinium, 1-decyl-4-(dimethylamino)-, iodide
CAS No: 89389-91-3 Catalog No: AG003WKI MDL No:
Product Description
Catalog Number:
AG003WKI
Chemical Name:
Pyridinium, 1-decyl-4-(dimethylamino)-, iodide
CAS Number:
89389-91-3
Molecular Formula:
C17H31IN2
Molecular Weight:
390.3459
IUPAC Name:
1-decyl-N,N-dimethylpyridin-1-ium-4-amine;iodide
InChI:
InChI=1S/C17H31N2.HI/c1-4-5-6-7-8-9-10-11-14-19-15-12-17(13-16-19)18(2)3;/h12-13,15-16H,4-11,14H2,1-3H3;1H/q+1;/p-1
InChI Key:
AJPUSADRRRUVNN-UHFFFAOYSA-M
SMILES:
CCCCCCCCCC[n+]1ccc(cc1)N(C)C.[I-]
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
390.153g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
390.353g/mol
Monoisotopic Mass:
390.153g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
7.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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