200,000+ products from a single source!
sales@angenechem.com
121620-83-5 | Pyridinium, 3-[(diethylamino)carbonyl]-1-[2-(dodecylamino)-2-oxoethyl]-, chloride (1:1)
CAS No: 121620-83-5 Catalog No: AG0015F6 MDL No:
Product Description
Catalog Number:
AG0015F6
Chemical Name:
Pyridinium, 3-[(diethylamino)carbonyl]-1-[2-(dodecylamino)-2-oxoethyl]-, chloride (1:1)
CAS Number:
121620-83-5
Molecular Formula:
C24H42ClN3O2
Molecular Weight:
440.0622
IUPAC Name:
1-[2-(dodecylamino)-2-oxoethyl]-N,N-diethylpyridin-1-ium-3-carboxamide;chloride
InChI:
InChI=1S/C24H41N3O2.ClH/c1-4-7-8-9-10-11-12-13-14-15-18-25-23(28)21-26-19-16-17-22(20-26)24(29)27(5-2)6-3;/h16-17,19-20H,4-15,18,21H2,1-3H3;1H
InChI Key:
RFULZZMJBWXYNI-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCNC(=O)C[n+]1cccc(c1)C(=O)N(CC)CC.[Cl-]
NSC Number:
141909
Properties
Complexity:
438
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
439.297g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
440.069g/mol
Monoisotopic Mass:
439.297g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
53.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.