N-(3-Bromobenzyl)-2-propen-1-amine
TL;DR: N-(3-Bromobenzyl)-2-propen-1-amine (CAS 893569-90-9) is a chemical compound with molecular formula C10H12BrN and molecular weight 225.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-bromophenyl)methyl]prop-2-en-1-amine
Also Known As: N-allyl-N-(3-bromobenzyl)amine, N-(3-BROMOBENZYL)-2-PROPEN-1-AMINE, N-(3-bromobenzyl)prop-2-en-1-amine, [(3-Bromophenyl)methyl](prop-2-en-1-yl)amine, N-[(3-bromophenyl)methyl]prop-2-en-1-amine
| Molecular Formula | C10H12BrN |
|---|---|
| Molecular Weight | 225.02 g/mol |
| LogP | 2.7247 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.0153 |
| Heavy Atoms | 12 |
| Complexity | 257.77042 |
Chemical Identifiers
| CAS Number | 893569-90-9 |
|---|---|
| SMILES | C=CCNCC1=CC(=CC=C1)Br |
Product Overview
N-(3-Bromobenzyl)-2-propen-1-amine (CAS 893569-90-9), with molecular formula C10H12BrN and molecular weight 225.02 g/mol. IUPAC: N-[(3-bromophenyl)methyl]prop-2-en-1-amine.
Chemical Property Profile of N-(3-Bromobenzyl)-2-propen-1-amine
Property Insights of N-(3-Bromobenzyl)-2-propen-1-amine
The XLogP value of 2.7247 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-Bromobenzyl)-2-propen-1-amine. With a topological polar surface area (TPSA) of 12.03 Ų, N-(3-Bromobenzyl)-2-propen-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Bromobenzyl)-2-propen-1-amine 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-Bromobenzyl)-2-propen-1-amine?
The CAS number of N-(3-Bromobenzyl)-2-propen-1-amine is 893569-90-9.
What is the molecular formula of N-(3-Bromobenzyl)-2-propen-1-amine?
The molecular formula of N-(3-Bromobenzyl)-2-propen-1-amine is C10H12BrN.
What is the molecular weight of N-(3-Bromobenzyl)-2-propen-1-amine?
The molecular weight of N-(3-Bromobenzyl)-2-propen-1-amine is 225.02 g/mol.
Where can I buy N-(3-Bromobenzyl)-2-propen-1-amine?
You can request a quote for N-(3-Bromobenzyl)-2-propen-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-Bromobenzyl)-2-propen-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-Bromobenzyl)-2-propen-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.