Diethylcarbamoyl chloride
TL;DR: Diethylcarbamoyl chloride (CAS 88-10-8) is a chemical compound with molecular formula C5H10ClNO and molecular weight 135.04509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethylcarbamoyl chloride
Also Known As: DIETHYLCARBAMOYL CHLORIDE, Diethylcarbamyl chloride, N,N-Diethylcarbamoyl chloride, Carbamic chloride, diethyl-, Diethylcarbamic chloride
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H10ClNO |
| Molecular Weight | 135.04509 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 135.04509 Da |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
| Melting Point | -32 °C |
| Boiling Point | 186 °C |
| Flash Point | 163 - 172 °C |
| Vapor Pressure | 0.72 [mmHg] |
| Solubility | SOL IN WATER |
| SMILES | CCN(CC)C(=O)Cl |
| InChIKey | OFCCYDUUBNUJIB-UHFFFAOYSA-N |
Product Description
Applications: Diethylcarbamoyl chloride is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A heterocyclic building block supplied by CoreyChem, Diethylcarbamoyl chloride (CAS 88-10-8) has the molecular formula C5H10ClNO and a molecular weight of 135.05 g/mol. Reported properties include a solubility: SOL IN WATER. Synonyms include DIETHYLCARBAMOYL CHLORIDE and Diethylcarbamyl chloride.
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 Diethylcarbamoyl chloride
Property Insights of Diethylcarbamoyl chloride
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethylcarbamoyl chloride. With a topological polar surface area (TPSA) of 20.3 Ų, Diethylcarbamoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylcarbamoyl chloride has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Diethylcarbamoyl chloride?
The CAS number of Diethylcarbamoyl chloride is 88-10-8.
What is the molecular formula of Diethylcarbamoyl chloride?
The molecular formula of Diethylcarbamoyl chloride is C5H10ClNO.
What is the molecular weight of Diethylcarbamoyl chloride?
The molecular weight of Diethylcarbamoyl chloride is 135.04509 g/mol.
What are the applications of Diethylcarbamoyl chloride?
Diethylcarbamoyl chloride is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy Diethylcarbamoyl chloride?
You can request a quote for Diethylcarbamoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethylcarbamoyl chloride?
Yes, CoreyChem provides custom synthesis services for Diethylcarbamoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.