200,000+ products from a single source!
sales@angenechem.com
121774-67-2 | Pyridinium, 1-[[[4-(dimethylamino)phenyl]methylene]amino]-2-methyl-6-(1-methylethyl)-, perchlorate (1:1)
CAS No: 121774-67-2 Catalog No: AG0015Y1 MDL No:
Product Description
Catalog Number:
AG0015Y1
Chemical Name:
Pyridinium, 1-[[[4-(dimethylamino)phenyl]methylene]amino]-2-methyl-6-(1-methylethyl)-, perchlorate (1:1)
CAS Number:
121774-67-2
Molecular Formula:
C18H24ClN3O4
Molecular Weight:
381.8539
IUPAC Name:
N,N-dimethyl-4-[(2-methyl-6-propan-2-ylpyridin-1-ium-1-yl)iminomethyl]aniline;perchlorate
InChI:
InChI=1S/C18H24N3.ClHO4/c1-14(2)18-8-6-7-15(3)21(18)19-13-16-9-11-17(12-10-16)20(4)5;2-1(3,4)5/h6-14H,1-5H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
HQJPHUMFAKVAAW-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.CN(c1ccc(cc1)C=N[n+]1c(C)cccc1C(C)C)C
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
381.146g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
381.857g/mol
Monoisotopic Mass:
381.146g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
93.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.