N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)
TL;DR: N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) (CAS 22353-34-0) is a chemical compound with molecular formula C12H19Br2N and molecular weight 334.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-bromo-2-phenylethyl)butan-1-amine;hydrobromide
Also Known As: beta-Bromo-N-butylphenethylamine hydrobromide, Phenethylamine, beta-bromo-N-butyl-, hydrobromide, n-(2-bromo-2-phenylethyl)butan-1-amine hydrobromide(1:1), N-(2-bromo-2-phenylethyl)butan-1-amine hydrobromide, N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)
| Molecular Formula | C12H19Br2N |
|---|---|
| Molecular Weight | 334.99 g/mol |
| LogP | 4.0902 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 334.98843 |
| Heavy Atoms | 15 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 22353-34-0 |
|---|---|
| SMILES | CCCCNCC(C1=CC=CC=C1)Br.Br |
| InChIKey | ANPLTBZYQXPEBV-UHFFFAOYSA-N |
Product Overview
N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) (CAS 22353-34-0), with molecular formula C12H19Br2N and molecular weight 334.99 g/mol. IUPAC: N-(2-bromo-2-phenylethyl)butan-1-amine;hydrobromide.
Chemical Property Profile of N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)
Property Insights of N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)
The XLogP value of 4.0902 indicates that N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) has 2 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-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)?
The CAS number of N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) is 22353-34-0.
What is the molecular formula of N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)?
The molecular formula of N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) is C12H19Br2N.
What is the molecular weight of N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)?
The molecular weight of N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) is 334.99 g/mol.
Where can I buy N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)?
You can request a quote for N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1)?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Bromo-2-phenylethyl)butan-1-amine--hydrogen bromide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.