3-Benzyl-4-methoxyaniline
TL;DR: 3-Benzyl-4-methoxyaniline (CAS 744948-83-2) is a chemical compound with molecular formula C14H15NO and molecular weight 213.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-4-methoxyaniline
Also Known As: 3-benzyl-4-methoxyaniline, Benzenamine, 4-methoxy-3-(phenylmethyl)-
| Molecular Formula | C14H15NO |
|---|---|
| Molecular Weight | 213.12 g/mol |
| LogP | 2.8682 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.11537 |
| Heavy Atoms | 16 |
| Complexity | 465.41647 |
Chemical Identifiers
| CAS Number | 744948-83-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)N)CC2=CC=CC=C2 |
Product Overview
3-Benzyl-4-methoxyaniline (CAS 744948-83-2), with molecular formula C14H15NO and molecular weight 213.12 g/mol. IUPAC: 3-benzyl-4-methoxyaniline.
Chemical Property Profile of 3-Benzyl-4-methoxyaniline
Property Insights of 3-Benzyl-4-methoxyaniline
The XLogP value of 2.8682 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Benzyl-4-methoxyaniline. With a topological polar surface area (TPSA) of 35.25 Ų, 3-Benzyl-4-methoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Benzyl-4-methoxyaniline has 1 hydrogen bond donor(s) and 2 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 3-Benzyl-4-methoxyaniline?
The CAS number of 3-Benzyl-4-methoxyaniline is 744948-83-2.
What is the molecular formula of 3-Benzyl-4-methoxyaniline?
The molecular formula of 3-Benzyl-4-methoxyaniline is C14H15NO.
What is the molecular weight of 3-Benzyl-4-methoxyaniline?
The molecular weight of 3-Benzyl-4-methoxyaniline is 213.12 g/mol.
Where can I buy 3-Benzyl-4-methoxyaniline?
You can request a quote for 3-Benzyl-4-methoxyaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Benzyl-4-methoxyaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Benzyl-4-methoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.