n,n-Diethyl-3-formylbenzamide
TL;DR: n,n-Diethyl-3-formylbenzamide (CAS 10549-57-2) is a chemical compound with molecular formula C12H15NO2 and molecular weight 205.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-3-formylbenzamide
Also Known As: n,n-diethyl-3-formylbenzamide, 3-formyl-n,n-diethylbenzamide, N,N-diethyl(3-formyl)benzamide, N,N-diethyl-3-formyl-benzamide, Benzamide, N,N-diethyl-3-formyl-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H15NO2 |
| Molecular Weight | 205.11028 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 37.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.11028 Da |
| Heavy Atoms | 15 |
| Complexity | 224.0 |
| SMILES | CCN(CC)C(=O)C1=CC=CC(=C1)C=O |
| InChIKey | HMYIYZWYYMNGCY-UHFFFAOYSA-N |
Chemical Property Profile of n,n-Diethyl-3-formylbenzamide
Property Insights of n,n-Diethyl-3-formylbenzamide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n,n-Diethyl-3-formylbenzamide. With a topological polar surface area (TPSA) of 37.4 Ų, n,n-Diethyl-3-formylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n,n-Diethyl-3-formylbenzamide has 0 hydrogen bond donor(s) and 2 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,n-Diethyl-3-formylbenzamide?
The CAS number of n,n-Diethyl-3-formylbenzamide is 10549-57-2.
What is the molecular formula of n,n-Diethyl-3-formylbenzamide?
The molecular formula of n,n-Diethyl-3-formylbenzamide is C12H15NO2.
What is the molecular weight of n,n-Diethyl-3-formylbenzamide?
The molecular weight of n,n-Diethyl-3-formylbenzamide is 205.11028 g/mol.
Where can I buy n,n-Diethyl-3-formylbenzamide?
You can request a quote for n,n-Diethyl-3-formylbenzamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for n,n-Diethyl-3-formylbenzamide?
Yes, CoreyChem provides custom synthesis services for n,n-Diethyl-3-formylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.