1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene
TL;DR: 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene (CAS 61172-10-9) is a chemical compound with molecular formula C20H13Br and molecular weight 332.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-bromo-2-[(E)-4-phenylbut-1-en-3-ynyl]naphthalene
Also Known As: 1-bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene, 1-bromo-2-[(E)-4-phenylbut-1-en-3-ynyl]naphthalene, AB-131/42301057, (E)-1-Bromo-2-(4-phenylbut-1-en-3-yn-1-yl)naphthalene
| Molecular Formula | C20H13Br |
|---|---|
| Molecular Weight | 332.02 g/mol |
| LogP | 5.6672 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.02005 |
| Heavy Atoms | 21 |
| Complexity | 849.136 |
Chemical Identifiers
| CAS Number | 61172-10-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#C/C=C/C2=C(C3=CC=CC=C3C=C2)Br |
Product Overview
1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene (CAS 61172-10-9), with molecular formula C20H13Br and molecular weight 332.02 g/mol. IUPAC: 1-bromo-2-[(E)-4-phenylbut-1-en-3-ynyl]naphthalene.
Chemical Property Profile of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene
Property Insights of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene
The XLogP value of 5.6672 indicates that 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene 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-(4-phenyl-1-buten-3-ynyl)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene?
The CAS number of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene is 61172-10-9.
What is the molecular formula of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene?
The molecular formula of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene is C20H13Br.
What is the molecular weight of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene?
The molecular weight of 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene is 332.02 g/mol.
Where can I buy 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene?
You can request a quote for 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene 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-(4-phenyl-1-buten-3-ynyl)naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-Bromo-2-(4-phenyl-1-buten-3-ynyl)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.