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

1. Primary Information

English name: Dimethyl Phosphate-13C2 Sodium Salt
CAS No.: 157487-95-1
Molecular formula: C2H6NAO4P
Molecular weight: 150.016 g/mol
SMILES: COP(=O)([O-])OC.[Na+]
Structural class:
Other identifiers:

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2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 0.5mg - 2880 2-8°C in stock -

3. Structures

3.1 2D structure


3.2 3D structure

Coming soon

4. International Nomenclature & Identifiers

4.1 IUPAC Name

sodium;di(113C)methyl phosphate


4.2 InChI

InChI=1S/C2H7O4P.Na/c1-5-7(3,4)6-2;/h1-2H3,(H,3,4);/q;+1/p-1/i1+1,2+1;


4.3 InChIKey

LMGRDVWNCARTPS-AWQJXPNKSA-M


4.4 Canonical SMILES

COP(=O)([O-])OC.[Na+]


4.5 Isomeric SMILES

[13CH3]OP(=O)([O-])O[13CH3].[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 --