4-(3-Bromopropyl)aniline
TL;DR: 4-(3-Bromopropyl)aniline (CAS 299402-47-4) is a chemical compound with molecular formula C9H12BrN and molecular weight 213.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3-bromopropyl)aniline
Also Known As: 4-(3-bromopropyl)aniline
| Molecular Formula | C9H12BrN |
|---|---|
| Molecular Weight | 213.02 g/mol |
| LogP | 2.5963 |
| Topological Polar Surface Area | 26.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.0153 |
| Heavy Atoms | 11 |
| Complexity | 205.30765 |
Chemical Identifiers
| CAS Number | 299402-47-4 |
|---|---|
| SMILES | C1=CC(=CC=C1CCCBr)N |
Product Overview
4-(3-Bromopropyl)aniline (CAS 299402-47-4), with molecular formula C9H12BrN and molecular weight 213.02 g/mol. IUPAC: 4-(3-bromopropyl)aniline.
Chemical Property Profile of 4-(3-Bromopropyl)aniline
Property Insights of 4-(3-Bromopropyl)aniline
The XLogP value of 2.5963 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(3-Bromopropyl)aniline. With a topological polar surface area (TPSA) of 26.02 Ų, 4-(3-Bromopropyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(3-Bromopropyl)aniline 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 4-(3-Bromopropyl)aniline?
The CAS number of 4-(3-Bromopropyl)aniline is 299402-47-4.
What is the molecular formula of 4-(3-Bromopropyl)aniline?
The molecular formula of 4-(3-Bromopropyl)aniline is C9H12BrN.
What is the molecular weight of 4-(3-Bromopropyl)aniline?
The molecular weight of 4-(3-Bromopropyl)aniline is 213.02 g/mol.
Where can I buy 4-(3-Bromopropyl)aniline?
You can request a quote for 4-(3-Bromopropyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Bromopropyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Bromopropyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.