N-Nitrosodiethylamine
TL;DR: N-Nitrosodiethylamine (CAS 55-18-5) is a chemical compound with molecular formula C4H10N2O and molecular weight 102.079315 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethylnitrous amide
Also Known As: N-NITROSODIETHYLAMINE, Diethylnitrosamine, NDEA, Diethylnitrosoamine, Nitrosodiethylamine
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H10N2O |
| Molecular Weight | 102.079315 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.079315 Da |
| Heavy Atoms | 7 |
| Complexity | 51.0 |
| Boiling Point | 351 °F at 760 mmHg (NTP, 1992) |
| Density | 0.9422 at 68 °F (NTP, 1992) - Less dense than water; will float |
| Flash Point | 145 °F (NTP, 1992) |
| Vapor Pressure | 5.7 mmHg at 77 °F ; 8.8 mmHg at 94.1 °F (NTP, 1992) |
| Refractive Index | Index of refraction: 1.4386 at 20 °C/D |
| Solubility | greater than or equal to 100 mg/mL at 70 °F (NTP, 1992) |
| SMILES | CCN(CC)N=O |
| InChIKey | WBNQDOYYEUMPFS-UHFFFAOYSA-N |
Product Description
Applications: N-Nitrosodiethylamine is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N-Nitrosodiethylamine (CAS 55-18-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
N-Nitrosodiethylamine is a pharmaceutical intermediate identified by CAS number 55-18-5 and the molecular formula C4H10N2O and a molecular weight of 102.08 g/mol. Physically, the compound has a density of 0.9422 at 68 °F (NTP, 1992) - Less dense than water; will float g/cm³, a solubility: greater than or equal to 100 mg/mL at 70 °F (NTP, 1992). It is also known as N-NITROSODIETHYLAMINE and Diethylnitrosamine.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of N-Nitrosodiethylamine
Property Insights of N-Nitrosodiethylamine
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nitrosodiethylamine. With a topological polar surface area (TPSA) of 32.7 Ų, N-Nitrosodiethylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Nitrosodiethylamine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-Nitrosodiethylamine?
The CAS number of N-Nitrosodiethylamine is 55-18-5.
What is the molecular formula of N-Nitrosodiethylamine?
The molecular formula of N-Nitrosodiethylamine is C4H10N2O.
What is the molecular weight of N-Nitrosodiethylamine?
The molecular weight of N-Nitrosodiethylamine is 102.079315 g/mol.
What are the applications of N-Nitrosodiethylamine?
N-Nitrosodiethylamine is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies N-Nitrosodiethylamine (CAS 55-18-5) with custom synthesis...
Where can I buy N-Nitrosodiethylamine?
You can request a quote for N-Nitrosodiethylamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Nitrosodiethylamine?
Yes, CoreyChem provides custom synthesis services for N-Nitrosodiethylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.