N,3,4-Trimethylbenzamide
TL;DR: N,3,4-Trimethylbenzamide (CAS 3400-36-0) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,3,4-trimethylbenzamide
Also Known As: N,3,4-trimethylbenzamide, Benzamide,N,3,4-trimethyl-, N-methyl-3,4-dimethylbenzamide, Benzamide, N,3,4-trimethyl- (7CI,8CI,9CI), RefChem:358204
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 1.66304 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 304.70694 |
Chemical Identifiers
| CAS Number | 3400-36-0 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)NC)C |
Product Overview
N,3,4-Trimethylbenzamide (CAS 3400-36-0), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: N,3,4-trimethylbenzamide.
Chemical Property Profile of N,3,4-Trimethylbenzamide
Property Insights of N,3,4-Trimethylbenzamide
The XLogP value of 1.66304 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,3,4-Trimethylbenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N,3,4-Trimethylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,3,4-Trimethylbenzamide has 1 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 N,3,4-Trimethylbenzamide?
The CAS number of N,3,4-Trimethylbenzamide is 3400-36-0.
What is the molecular formula of N,3,4-Trimethylbenzamide?
The molecular formula of N,3,4-Trimethylbenzamide is C10H13NO.
What is the molecular weight of N,3,4-Trimethylbenzamide?
The molecular weight of N,3,4-Trimethylbenzamide is 163.10 g/mol.
Where can I buy N,3,4-Trimethylbenzamide?
You can request a quote for N,3,4-Trimethylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,3,4-Trimethylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N,3,4-Trimethylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.