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19260-05-0 | 1H-Indole-3-methanaminium, N,N,N,1-tetramethyl-, iodide (1:1)
CAS No: 19260-05-0 Catalog No: AG002G56 MDL No:
Product Description
Catalog Number:
AG002G56
Chemical Name:
1H-Indole-3-methanaminium, N,N,N,1-tetramethyl-, iodide (1:1)
CAS Number:
19260-05-0
Molecular Formula:
C13H19IN2
Molecular Weight:
330.2078
IUPAC Name:
trimethyl-[(1-methylindol-3-yl)methyl]azanium;iodide
InChI:
InChI=1S/C13H19N2.HI/c1-14-9-11(10-15(2,3)4)12-7-5-6-8-13(12)14;/h5-9H,10H2,1-4H3;1H/q+1;/p-1
InChI Key:
MCISKWAIYBFHAV-UHFFFAOYSA-M
SMILES:
Cn1cc(c2c1cccc2)C[N+](C)(C)C.[I-]
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.059g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
330.213g/mol
Monoisotopic Mass:
330.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
4.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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