2-甲基-N,N-二乙基苯甲酰胺
TL;DR: 2-甲基-N,N-二乙基苯甲酰胺 (CAS 2728-04-3) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-甲基-N,N-二乙基苯甲酰胺
N,N-diethyl-2-methylbenzamide
Also Known As: N,N-Diethyl-2-methylbenzamide, Diethyltoluamide, o-DETA, o-DEET, N,N-diethyltoluamide
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 2728-04-3 |
|---|---|
| SMILES | CCN(CC)C(=O)C1=CC=CC=C1C |
| InChIKey | KUYQDJOFVBGZID-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-甲基-N,N-二乙基苯甲酰胺 (CAS 2728-04-3), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: N,N-diethyl-2-methylbenzamide.
Chemical Property Profile of 2-甲基-N,N-二乙基苯甲酰胺
Property Insights of 2-甲基-N,N-二乙基苯甲酰胺
The XLogP value of 3.1 indicates that 2-甲基-N,N-二乙基苯甲酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2-甲基-N,N-二乙基苯甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-甲基-N,N-二乙基苯甲酰胺 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-甲基-N,N-二乙基苯甲酰胺?
The CAS number of 2-甲基-N,N-二乙基苯甲酰胺 is 2728-04-3.
What is the molecular formula of 2-甲基-N,N-二乙基苯甲酰胺?
The molecular formula of 2-甲基-N,N-二乙基苯甲酰胺 is C12H17NO.
What is the molecular weight of 2-甲基-N,N-二乙基苯甲酰胺?
The molecular weight of 2-甲基-N,N-二乙基苯甲酰胺 is 191.13 g/mol.
Where can I buy 2-甲基-N,N-二乙基苯甲酰胺?
You can request a quote for 2-甲基-N,N-二乙基苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-甲基-N,N-二乙基苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 2-甲基-N,N-二乙基苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.