200,000+ products from a single source!
sales@angenechem.com
100930-12-9 | Ethanaminium, 2,2'-[(1,8-dioxo-1,8-octanediyl)bis(oxy)]bis[N,N,N-trimethyl-, dichloride (9CI)
CAS No: 100930-12-9 Catalog No: AG000385 MDL No:
Product Description
Catalog Number:
AG000385
Chemical Name:
Ethanaminium, 2,2'-[(1,8-dioxo-1,8-octanediyl)bis(oxy)]bis[N,N,N-trimethyl-, dichloride (9CI)
CAS Number:
100930-12-9
Molecular Formula:
C18H38Cl2N2O4
Molecular Weight:
417.4113
IUPAC Name:
trimethyl-[2-[8-oxo-8-[2-(trimethylazaniumyl)ethoxy]octanoyl]oxyethyl]azanium;dichloride
InChI:
InChI=1S/C18H38N2O4.2ClH/c1-19(2,3)13-15-23-17(21)11-9-7-8-10-12-18(22)24-16-14-20(4,5)6;;/h7-16H2,1-6H3;2*1H/q+2;;/p-2
InChI Key:
MGNXGLROGDRCGJ-UHFFFAOYSA-L
SMILES:
O=C(OCC[N+](C)(C)C)CCCCCCC(=O)OCC[N+](C)(C)C.[Cl-].[Cl-]
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
416.221g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
417.412g/mol
Monoisotopic Mass:
416.221g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.