Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: 2,6-Dichloroindophenol sodium salt
CAS No.: 620-45-1
Molecular formula: C12H6Cl2NNAO2
Molecular weight: 290.07 g/mol
SMILES: C1=CC(=CC=C1N=C2C=C(C(=O)C(=C2)Cl)Cl)[O-].[Na+]
Structural class:
Other identifiers:

2,6 Dichlorobenzenoneindophenol Dye

2,6 Dichloroindophenol

2,6 Dichlorophenolindophenol

2,6-Dichlorobenzenoneindophenol Dye

2,6-Dichloroindophenol

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 500mg 98% 160 -20℃ in stock -
Kehua Intelligence 1g 高纯,97% 64 -20℃ in stock -
Kehua Intelligence 5g 高纯,97% 180 -20℃ in stock -
Kehua Intelligence 25g 高纯,97% 696 -20℃ in stock -
Kehua Intelligence 100g 高纯,97% 2600 -20℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure

Coming soon

4. International Nomenclature & Identifiers

4.1 IUPAC Name

sodium;4-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)amino]phenolate


4.2 InChI

InChI=1S/C12H7Cl2NO2.Na/c13-10-5-8(6-11(14)12(10)17)15-7-1-3-9(16)4-2-7;/h1-6,16H;/q;+1/p-1


4.3 InChIKey

CVSUAFOWIXUYQA-UHFFFAOYSA-M


4.4 Canonical SMILES

C1=CC(=CC=C1N=C2C=C(C(=O)C(=C2)Cl)Cl)[O-].[Na+]


4.5 Isomeric SMILES

-

4.6 SDF file

Coming soon

5. Spectroscopic data

5.1 13C nuclear magnetic resonance (13C NMR)

5.2 1H nuclear magnetic resonance (1H NMR)

5.3 Mass spectrometry (MS)

Coming soon

5.4 Infrared spectroscopy (IR)

Coming soon

5.5 Ultraviolet/visible spectroscopy (UV/Vis)

Coming soon
-- No 3D model data available --