1,8-Octanediaminium, N,N′-bis[[3-[[(dimethylamino)carbonyl]oxy]-2-pyridinyl]methyl]-N,N,N′,N′-tetramethyl-, dibromide

CAS Registry Number®

110913-95-6

CAS Name

1,8-Octanediaminium, N,N′-bis[[3-[[(dimethylamino)carbonyl]oxy]-2-pyridinyl]methyl]-N,N,N′,N′-tetramethyl-, dibromide

Molecular Formula

C30H50N6O4.2Br

Cite this Page

1,8-Octanediaminium, N,N′-bis[[3-[[(dimethylamino)carbonyl]oxy]-2-pyridinyl]methyl]-N,N,N′,N′-tetramethyl-, dibromide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=110913-95-6 (retrieved 2024-11-22) (CAS RN: 110913-95-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    190-191 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C30H50N6O4.2BrH/c1-33(2)29(37)39-27-17-15-19-31-25(27)23-35(5,6)21-13-11-9-10-12-14-22-36(7,8)24-26-28(18-16-20-32-26)40-30(38)34(3)4;;/h15-20H,9-14,21-24H2,1-8H3;2*1H/q+2;;/p-2

InChIKey

InChIKey=ABTAGUMOWVVEGK-UHFFFAOYSA-L

SMILES

O(C(N(C)C)=O)C1=C(C[N+](CCCCCCCC[N+](CC2=C(OC(N(C)C)=O)C=CC=N2)(C)C)(C)C)N=CC=C1.[Br-]

Canonical SMILES

[Br-].O=C(OC1=CC=CN=C1C[N+](C)(C)CCCCCCCC[N+](C)(C)CC2=NC=CC=C2OC(=O)N(C)C)N(C)C

Other Names for this Substance

  • 1,8-Octanediaminium, N,N′-bis[[3-[[(dimethylamino)carbonyl]oxy]-2-pyridinyl]methyl]-N,N,N′,N′-tetramethyl-, dibromide
  • EA-3990

CAS INSIGHTSTM
Targeted protein degrader structure, illustration