4-Bromobenzylamine
TL;DR: 4-Bromobenzylamine (CAS 3959-07-7) is a chemical compound with molecular formula C7H8BrN and molecular weight 184.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)methanamine
Also Known As: 4-Bromobenzylamine, (4-Bromophenyl)methanamine, p-Bromobenzylamine, 4-Bromo-benzylamine, Benzenemethanamine, 4-bromo-
| Molecular Formula | C7H8BrN |
|---|---|
| Molecular Weight | 184.98 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 184.98401 |
| Heavy Atoms | 9 |
| Complexity | 77.0 |
Chemical Identifiers
| CAS Number | 3959-07-7 |
|---|---|
| SMILES | C1=CC(=CC=C1CN)Br |
| InChIKey | XRNVSPDQTPVECU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromobenzylamine (CAS 3959-07-7), with molecular formula C7H8BrN and molecular weight 184.98 g/mol. IUPAC: (4-bromophenyl)methanamine.
Chemical Property Profile of 4-Bromobenzylamine
Property Insights of 4-Bromobenzylamine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromobenzylamine. With a topological polar surface area (TPSA) of 26.0 Ų, 4-Bromobenzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromobenzylamine 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-Bromobenzylamine?
The CAS number of 4-Bromobenzylamine is 3959-07-7.
What is the molecular formula of 4-Bromobenzylamine?
The molecular formula of 4-Bromobenzylamine is C7H8BrN.
What is the molecular weight of 4-Bromobenzylamine?
The molecular weight of 4-Bromobenzylamine is 184.98 g/mol.
Where can I buy 4-Bromobenzylamine?
You can request a quote for 4-Bromobenzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromobenzylamine?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromobenzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.