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

1. Primary Information

English name: Monosodium maleate
CAS No.: 3105-55-3
Molecular formula: C4H3NAO4
Molecular weight: 138.05 g/mol
SMILES: C(=CC(=O)[O-])C(=O)O.[Na+]
Structural class:
Other identifiers:

hydrogen maleate

maleate

maleic acid

maleic acid, ammonium salt

maleic acid, calcium salt

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 1g BR,99% 60 RT in stock -
Kehua Intelligence 5g BR,99% 224 RT in stock -
Kehua Intelligence 25g BR,99% 760 RT in stock -

3. Structures

3.1 2D structure


3.2 3D structure

Coming soon

4. International Nomenclature & Identifiers

4.1 IUPAC Name

sodium;(Z)-4-hydroxy-4-oxobut-2-enoate


4.2 InChI

InChI=1S/C4H4O4.Na/c5-3(6)1-2-4(7)8;/h1-2H,(H,5,6)(H,7,8);/q;+1/p-1/b2-1-;


4.3 InChIKey

VRVKOZSIJXBAJG-ODZAUARKSA-M


4.4 Canonical SMILES

C(=CC(=O)[O-])C(=O)O.[Na+]


4.5 Isomeric SMILES

C(=C\C(=O)[O-])\C(=O)O.[Na+]

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 --