2-bromo-N,N-diethylacetamide
TL;DR: 2-bromo-N,N-diethylacetamide (CAS 6947-01-9) is a chemical compound with molecular formula C6H12BrNO and molecular weight 193.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-N,N-diethylacetamide
Also Known As: 2-bromo-n,n-diethylacetamide, 2-Bromo-N,N-diethyl-acetamide, N,N-diethylbromoacetamide, n,n-diethyl-2-bromoacetamide, N-(Bromoacetyl)diethylamine
| Molecular Formula | C6H12BrNO |
|---|---|
| Molecular Weight | 193.01 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.01022 |
| Heavy Atoms | 9 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 6947-01-9 |
|---|---|
| SMILES | CCN(CC)C(=O)CBr |
| InChIKey | LHNPENNQGSGOTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-bromo-N,N-diethylacetamide (CAS 6947-01-9), with molecular formula C6H12BrNO and molecular weight 193.01 g/mol. IUPAC: 2-bromo-N,N-diethylacetamide.
Chemical Property Profile of 2-bromo-N,N-diethylacetamide
Property Insights of 2-bromo-N,N-diethylacetamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-bromo-N,N-diethylacetamide. With a topological polar surface area (TPSA) of 20.3 Ų, 2-bromo-N,N-diethylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-bromo-N,N-diethylacetamide 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
Frequently Asked Questions
What is the CAS number of 2-bromo-N,N-diethylacetamide?
The CAS number of 2-bromo-N,N-diethylacetamide is 6947-01-9.
What is the molecular formula of 2-bromo-N,N-diethylacetamide?
The molecular formula of 2-bromo-N,N-diethylacetamide is C6H12BrNO.
What is the molecular weight of 2-bromo-N,N-diethylacetamide?
The molecular weight of 2-bromo-N,N-diethylacetamide is 193.01 g/mol.
Where can I buy 2-bromo-N,N-diethylacetamide?
You can request a quote for 2-bromo-N,N-diethylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-bromo-N,N-diethylacetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-bromo-N,N-diethylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.