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139622-17-6 | Acridinium, 9-(diethylamino)-10-methyl-, perchlorate (1:1)
CAS No: 139622-17-6 Catalog No: AG001BE8 MDL No:
Product Description
Catalog Number:
AG001BE8
Chemical Name:
Acridinium, 9-(diethylamino)-10-methyl-, perchlorate (1:1)
CAS Number:
139622-17-6
Molecular Formula:
C18H21ClN2O4
Molecular Weight:
364.8233
IUPAC Name:
N,N-diethyl-10-methylacridin-10-ium-9-amine;perchlorate
InChI:
InChI=1S/C18H21N2.ClHO4/c1-4-20(5-2)18-14-10-6-8-12-16(14)19(3)17-13-9-7-11-15(17)18;2-1(3,4)5/h6-13H,4-5H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
CBCFVGQFUGUHOK-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.CCN(c1c2ccccc2[n+](c2c1cccc2)C)CC
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
364.119g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
364.826g/mol
Monoisotopic Mass:
364.119g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
81.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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