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Home > Indoles and Oxindole > 74332-90-4
74332-90-4 | Pyrrolidinium, 1-(1-methyl-1H-indol-3-yl)methylene-1, perchlorate
CAS No: 74332-90-4 Catalog No: AG005Y2A MDL No:
Product Description
Catalog Number:
AG005Y2A
Chemical Name:
Pyrrolidinium, 1-(1-methyl-1H-indol-3-yl)methylene-1, perchlorate
CAS Number:
74332-90-4
Molecular Formula:
C14H17ClN2O4
Molecular Weight:
312.7488
IUPAC Name:
1-methyl-3-(pyrrolidin-1-ium-1-ylidenemethyl)indole;perchlorate
InChI:
InChI=1S/C14H17N2.ClHO4/c1-15-10-12(11-16-8-4-5-9-16)13-6-2-3-7-14(13)15;2-1(3,4)5/h2-3,6-7,10-11H,4-5,8-9H2,1H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
FFVJRYSGWBNECM-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.Cn1cc(c2c1cccc2)C=[N+]1CCCC1
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.088g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.75g/mol
Monoisotopic Mass:
312.088g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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