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

1. Primary Information

English name: (3-Chlorophenyl)hydrazonomalononitrile
CAS No.: 555-60-2
Molecular formula: C9H5ClN4
Molecular weight: 204.61 g/mol
SMILES: C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N
Structural class:
Other identifiers:

4-Chlorophenylhydrazone, Carbonylcyanide

Carbonyl Cyanide m Chlorophenyl Hydrazone

Carbonyl Cyanide m-Chlorophenyl Hydrazone

Carbonyl Cyanide meta Chlorophenyl Hydrazone

Carbonyl Cyanide meta-Chlorophenyl Hydrazone

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 25mg 99% 152 -20℃ in stock -
Kehua Intelligence 50mg 99% 240 -20℃ in stock -
Kehua Intelligence 250mg 99% 720 -20℃ in stock -
Kehua Intelligence 1g 99% 2160 -20℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure


4. International Nomenclature & Identifiers

4.1 IUPAC Name

2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile


4.2 InChI

InChI=1S/C9H5ClN4/c10-7-2-1-3-8(4-7)13-14-9(5-11)6-12/h1-4,13H


4.3 InChIKey

UGTJLJZQQFGTJD-UHFFFAOYSA-N


4.4 Canonical SMILES

C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N


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