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Home > Indoles and Oxindole > 82485-29-8
82485-29-8 | Pyridinium, 4-(1H-indol-1-ylmethyl)-1-methyl-, iodide
CAS No: 82485-29-8 Catalog No: AG0059JQ MDL No:
Product Description
Catalog Number:
AG0059JQ
Chemical Name:
Pyridinium, 4-(1H-indol-1-ylmethyl)-1-methyl-, iodide
CAS Number:
82485-29-8
Molecular Formula:
C15H15IN2
Molecular Weight:
350.1975
IUPAC Name:
1-[(1-methylpyridin-1-ium-4-yl)methyl]indole;iodide
InChI:
InChI=1S/C15H15N2.HI/c1-16-9-6-13(7-10-16)12-17-11-8-14-4-2-3-5-15(14)17;/h2-11H,12H2,1H3;1H/q+1;/p-1
InChI Key:
USIPLPMGVGWUKS-UHFFFAOYSA-M
SMILES:
C[n+]1ccc(cc1)Cn1ccc2c1cccc2.[I-]
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.028g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
350.203g/mol
Monoisotopic Mass:
350.028g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
8.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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