Benzothiazolium, 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-, benzoate (1:1)

CAS Registry Number®

68310-89-4

CAS Name

Benzothiazolium, 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-, benzoate (1:1)

Molecular Formula

C17H19N2S.C7H5O2

Molecular Mass

404.53

Cite this Page

Benzothiazolium, 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-, benzoate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68310-89-4 (retrieved 2025-04-04) (CAS RN: 68310-89-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H19N2S.C7H6O2/c1-12-5-10-15-16(11-12)20-17(19(15)4)13-6-8-14(9-7-13)18(2)3;8-7(9)6-4-2-1-3-5-6/h5-11H,1-4H3;1-5H,(H,8,9)/q+1;/p-1

InChIKey

InChIKey=YLNRZMQISIVORD-UHFFFAOYSA-M

SMILES

C[N+]1=C(SC=2C1=CC=C(C)C2)C3=CC=C(N(C)C)C=C3.C([O-])(=O)C1=CC=CC=C1

Canonical SMILES

O=C([O-])C=1C=CC=CC1.S1C=2C=C(C=CC2[N+](=C1C3=CC=C(C=C3)N(C)C)C)C

Other Names for this Substance

  • Benzothiazolium, 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-, benzoate (1:1)
  • Benzothiazolium, 2-[4-(dimethylamino)phenyl]-3,6-dimethyl-, benzoate
  • C.I. Pigment Yellow 18 (fugitive) benzoic acid salt

CAS INSIGHTSTM
Cell Membrane Phospholipid Structure,Phospholipid bilayer of the cell membrane, Lipid bilayer