1-Bromo-2-(but-3-yn-1-yl)benzene
TL;DR: 1-Bromo-2-(but-3-yn-1-yl)benzene (CAS 136015-72-0) is a chemical compound with molecular formula C10H9Br and molecular weight 207.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-but-3-ynylbenzene
Also Known As: 1-bromo-2-(but-3-yn-1-yl)benzene, 1-(3-butynyl)-2-bromobenzene, 1-bromo-2-but-3-ynyl-benzene, 2-(3-Butynyl)phenyl bromide, 1-bromo-2-but-3-ynylbenzene
| Molecular Formula | C10H9Br |
|---|---|
| Molecular Weight | 207.99 g/mol |
| LogP | 3.0149 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 207.98875 |
| Heavy Atoms | 11 |
| Complexity | 270.4464 |
Chemical Identifiers
| CAS Number | 136015-72-0 |
|---|---|
| SMILES | C#CCCC1=CC=CC=C1Br |
Product Overview
1-Bromo-2-(but-3-yn-1-yl)benzene (CAS 136015-72-0), with molecular formula C10H9Br and molecular weight 207.99 g/mol. IUPAC: 1-bromo-2-but-3-ynylbenzene.
Chemical Property Profile of 1-Bromo-2-(but-3-yn-1-yl)benzene
Property Insights of 1-Bromo-2-(but-3-yn-1-yl)benzene
The XLogP value of 3.0149 indicates that 1-Bromo-2-(but-3-yn-1-yl)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Bromo-2-(but-3-yn-1-yl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-(but-3-yn-1-yl)benzene has 0 hydrogen bond donor(s) and 0 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 1-Bromo-2-(but-3-yn-1-yl)benzene?
The CAS number of 1-Bromo-2-(but-3-yn-1-yl)benzene is 136015-72-0.
What is the molecular formula of 1-Bromo-2-(but-3-yn-1-yl)benzene?
The molecular formula of 1-Bromo-2-(but-3-yn-1-yl)benzene is C10H9Br.
What is the molecular weight of 1-Bromo-2-(but-3-yn-1-yl)benzene?
The molecular weight of 1-Bromo-2-(but-3-yn-1-yl)benzene is 207.99 g/mol.
Where can I buy 1-Bromo-2-(but-3-yn-1-yl)benzene?
You can request a quote for 1-Bromo-2-(but-3-yn-1-yl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Bromo-2-(but-3-yn-1-yl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-(but-3-yn-1-yl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.