Methylene blue trihydrate

CAS Registry Number®

7220-79-3

CAS Name

Methylene blue trihydrate

Molecular Formula

C16H18N3S.Cl.3H2O

Cite this Page

Methylene blue trihydrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7220-79-3 (retrieved 2024-11-21) (CAS RN: 7220-79-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H18N3S.ClH.3H2O/c1-18(2)11-5-7-13-15(9-11)20-16-10-12(19(3)4)6-8-14(16)17-13;;;;/h5-10H,1-4H3;1H;3*1H2/q+1;;;;/p-1

InChIKey

InChIKey=XQAXGZLFSSPBMK-UHFFFAOYSA-M

SMILES

N(C)(C)C1=CC2=C(N=C3C(=[S+]2)C=C(N(C)C)C=C3)C=C1.[Cl-].O

Canonical SMILES

[Cl-].O.N=1C2=CC=C(C=C2[S+]=C3C=C(C=CC13)N(C)C)N(C)C

Other Names for this Substance

  • Phenothiazin-5-ium, 3,7-bis(dimethylamino)-, chloride, hydrate (1:1:3)
  • C.I. Basic Blue 9, trihydrate
  • Phenothiazin-5-ium, 3,7-bis(dimethylamino)-, chloride, trihydrate
  • 3,7-Bis(dimethylamino)phenazathionium chloride trihydrate
  • Methylene blue trihydrate

CAS INSIGHTSTM
Targeted protein degrader structure, illustration