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

1. Primary Information

English name: 2,6-dichloro-N-hydroxybenzenecarboximidoyl chloride
CAS No.: 6579-27-7
Molecular formula: C7H4Cl3NO
Molecular weight: 224.5 g/mol
SMILES: C1=CC(=C(C(=C1)Cl)C(=NO)Cl)Cl
Structural class:
Other identifiers:

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2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 1g 98% 1056 RT in stock -

3. Structures

3.1 2D structure


3.2 3D structure


4. International Nomenclature & Identifiers

4.1 IUPAC Name

(1Z)-2,6-dichloro-N-hydroxybenzenecarboximidoyl chloride


4.2 InChI

InChI=1S/C7H4Cl3NO/c8-4-2-1-3-5(9)6(4)7(10)11-12/h1-3,12H/b11-7-


4.3 InChIKey

LXWQVTNZUIURFE-XFFZJAGNSA-N


4.4 Canonical SMILES

C1=CC(=C(C(=C1)Cl)C(=NO)Cl)Cl


4.5 Isomeric SMILES

C1=CC(=C(C(=C1)Cl)/C(=N/O)/Cl)Cl

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