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

1. Primary Information

English name: 2,4,6-Tribromophenol
CAS No.: 118-79-6
Molecular formula: C6H3BR3O
Molecular weight: 330.80 g/mol
SMILES: C1=C(C=C(C(=C1Br)O)Br)Br
Structural class:
Other identifiers:

2,4,6-tribromophenol

2,4,6-tribromophenol, bismuth (3+) salt

bismuth tribromophenate

Xeroform

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 1.2ml 2000μg/ml in methanol 360 2-8℃ in stock -
Kehua Intelligence 1.2ml 100μg/ml in methanol 152 2-8℃ in stock -
Kehua Intelligence 250mg GC≥99% 568 2-8℃ in stock -
Kehua Intelligence 100g CP,98% 52 2-8℃ in stock -
Kehua Intelligence 500g CP,98% 168 2-8℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure


4. International Nomenclature & Identifiers

4.1 IUPAC Name

2,4,6-tribromophenol


4.2 InChI

InChI=1S/C6H3Br3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H


4.3 InChIKey

BSWWXRFVMJHFBN-UHFFFAOYSA-N


4.4 Canonical SMILES

C1=C(C=C(C(=C1Br)O)Br)Br


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