HuagongsheHuagongshe Chemistry Print Report · For research reference only
1,1-Bis(methylamino)-2-nitroethene
Nizatidine IMpurity A · Nizatidine EP IMpurity A · Ranitidine EP Impurity L · N,N'-Dimethyl-2-nitroethene-1,1-dia · N,N'-Dimethyl-2-nitro-1,1-ethendiamine · N,N'-dimethyl-2-nitro-1,1-ethenediamine · N,N'-Dimethyl-2-nitroethene-1,1-diamine · 1,1-Ethenediamine, N,N'-dimethyl-2-nitro-

Identifiers & Physical Properties
| CAS No. | 54252-45-8 |
|---|---|
| Molecular formula | C4H9N3O2 |
| Average molar mass | 131.13 g/mol |
| Monoisotopic mass | 131.06947653 g/mol |
| SMILES | CNC(=C[N+](=O)[O-])NC |
| InChIKey | VQBVPDAUEBSGMB-UHFFFAOYSA-N |
| PubChem CID | 12377312 |
| EC No. | 641-813-6 |
| DTXSID | DTXSID80495172 |
Chemical & Physical Properties
| XLogP | 0.5 |
|---|---|
| Topological polar surface area | 69.9 |
| Hydrogen bond donors | 2 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 2 |
| Heavy atoms | 9 |
| Formal charge | 0 |
| Complexity | 120 |
| Melting point | >207°C (dec.) |
| Storage conditions | Amber Vial, -20°C Freezer, Under inert atmosphere |
| Solubility | DMSO (Slightly), Methanol (Slightly) |
| Physical state | Solid |
| Color | White |
| FDA UNII | X2PTM6CJ26 |
Safety & Regulations
| GHS classification | DangerH360 (100%): May damage fertility or the unborn child [Danger Reproductive toxicity]P203, P280, P318, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory. |
|---|
Applications & Uses
Uses
N,N'-Dimethyl-2-nitro-1,1-ethenediamine is an impurity of the histamine H2-receptor antagonist Nizatidine (N598500) and Ranitidine (R120000).
Uses
N,N''-Dimethyl-2-nitro-1,1-ethenediamine is an impurity of the histamine H2-receptor antagonist Nizatidine (N598500) and Ranitidine (R120000).