2-[Bis[4-(dimethylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid

CAS Registry Number®

1255-69-2

CAS Name

2-[Bis[4-(dimethylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid

Molecular Formula

C26H31N3O2

Molecular Mass

417.54

Cite this Page

2-[Bis[4-(dimethylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1255-69-2 (retrieved 2024-11-22) (CAS RN: 1255-69-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    199-201 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C26H31N3O2/c1-27(2)20-11-7-18(8-12-20)25(19-9-13-21(14-10-19)28(3)4)23-16-15-22(29(5)6)17-24(23)26(30)31/h7-17,25H,1-6H3,(H,30,31)

InChIKey

InChIKey=BQGGOSXJLSPVRH-UHFFFAOYSA-N

SMILES

C(C1=C(C(O)=O)C=C(N(C)C)C=C1)(C2=CC=C(N(C)C)C=C2)C3=CC=C(N(C)C)C=C3

Canonical SMILES

O=C(O)C1=CC(=CC=C1C(C2=CC=C(C=C2)N(C)C)C3=CC=C(C=C3)N(C)C)N(C)C

Other Names for this Substance

  • Benzoic acid, 2-[bis[4-(dimethylamino)phenyl]methyl]-5-(dimethylamino)-
  • o-Toluic acid, 5-(dimethylamino)-α,α-bis[p-(dimethylamino)phenyl]-
  • 2-[Bis[4-(dimethylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid
  • Leucocrystal Violet lactone
  • 2-Carboxy-4,4′,4′′-tris(dimethylamino)triphenylmethane

CAS INSIGHTSTM
Targeted protein degrader structure, illustration