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Home > Indoles and Oxindole > 13330-41-1
13330-41-1 | 3H-Indolium, 1,2,3,3-tetramethyl-, perchlorate (1:1)
CAS No: 13330-41-1 Catalog No: AG0014KZ MDL No:
Product Description
Catalog Number:
AG0014KZ
Chemical Name:
3H-Indolium, 1,2,3,3-tetramethyl-, perchlorate (1:1)
CAS Number:
13330-41-1
Molecular Formula:
C12H16ClNO4
Molecular Weight:
273.7127
IUPAC Name:
1,2,3,3-tetramethylindol-1-ium;perchlorate
InChI:
InChI=1S/C12H16N.ClHO4/c1-9-12(2,3)10-7-5-6-8-11(10)13(9)4;2-1(3,4)5/h5-8H,1-4H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
DRTPFKMRZXCGKX-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.C[N+]1=C(C)C(c2c1cccc2)(C)C
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.077g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.713g/mol
Monoisotopic Mass:
273.077g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
77.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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