4-bromo-N-(4-methoxybenzyl)aniline
TL;DR: 4-bromo-N-(4-methoxybenzyl)aniline (CAS 175357-73-0) is a chemical compound with molecular formula C14H14BrNO and molecular weight 291.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-N-[(4-methoxyphenyl)methyl]aniline
Also Known As: 4-bromo-N-(4-methoxybenzyl)aniline, 4-bromo-N-[(4-methoxyphenyl)methyl]aniline, (4-Bromo-phenyl)-(4-methoxy-benzyl)-amine, N-(4-Methoxybenzyl)-4-bromoaniline, BAS 01125041
| Molecular Formula | C14H14BrNO |
|---|---|
| Molecular Weight | 291.03 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.02588 |
| Heavy Atoms | 17 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 175357-73-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC2=CC=C(C=C2)Br |
| InChIKey | LJKLYFDMLGYRCA-UHFFFAOYSA-N |
Product Overview
4-bromo-N-(4-methoxybenzyl)aniline (CAS 175357-73-0), with molecular formula C14H14BrNO and molecular weight 291.03 g/mol. IUPAC: 4-bromo-N-[(4-methoxyphenyl)methyl]aniline.
Chemical Property Profile of 4-bromo-N-(4-methoxybenzyl)aniline
Property Insights of 4-bromo-N-(4-methoxybenzyl)aniline
The XLogP value of 4.1 indicates that 4-bromo-N-(4-methoxybenzyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, 4-bromo-N-(4-methoxybenzyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-bromo-N-(4-methoxybenzyl)aniline 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 4-bromo-N-(4-methoxybenzyl)aniline?
The CAS number of 4-bromo-N-(4-methoxybenzyl)aniline is 175357-73-0.
What is the molecular formula of 4-bromo-N-(4-methoxybenzyl)aniline?
The molecular formula of 4-bromo-N-(4-methoxybenzyl)aniline is C14H14BrNO.
What is the molecular weight of 4-bromo-N-(4-methoxybenzyl)aniline?
The molecular weight of 4-bromo-N-(4-methoxybenzyl)aniline is 291.03 g/mol.
Where can I buy 4-bromo-N-(4-methoxybenzyl)aniline?
You can request a quote for 4-bromo-N-(4-methoxybenzyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-N-(4-methoxybenzyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-N-(4-methoxybenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.