1-Phenyl-3,3-diethylpentyne
TL;DR: 1-Phenyl-3,3-diethylpentyne (CAS 80025-09-8) is a chemical compound with molecular formula C15H20 and molecular weight 200.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-diethylpent-1-ynylbenzene
Also Known As: 1-Phenyl-3,3-diethylpentyne, 3,3-diethylpent-1-ynylbenzene, (3,3-Diethylpent-1-yn-1-yl)benzene
| Molecular Formula | C15H20 |
|---|---|
| Molecular Weight | 200.16 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 200.1565 |
| Heavy Atoms | 15 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 80025-09-8 |
|---|---|
| SMILES | CCC(CC)(CC)C#CC1=CC=CC=C1 |
| InChIKey | FTNLQPIWNCYGTC-UHFFFAOYSA-N |
Product Overview
1-Phenyl-3,3-diethylpentyne (CAS 80025-09-8), with molecular formula C15H20 and molecular weight 200.16 g/mol. IUPAC: 3,3-diethylpent-1-ynylbenzene.
Chemical Property Profile of 1-Phenyl-3,3-diethylpentyne
Property Insights of 1-Phenyl-3,3-diethylpentyne
The XLogP value of 5.6 indicates that 1-Phenyl-3,3-diethylpentyne 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-Phenyl-3,3-diethylpentyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3,3-diethylpentyne 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-Phenyl-3,3-diethylpentyne?
The CAS number of 1-Phenyl-3,3-diethylpentyne is 80025-09-8.
What is the molecular formula of 1-Phenyl-3,3-diethylpentyne?
The molecular formula of 1-Phenyl-3,3-diethylpentyne is C15H20.
What is the molecular weight of 1-Phenyl-3,3-diethylpentyne?
The molecular weight of 1-Phenyl-3,3-diethylpentyne is 200.16 g/mol.
Where can I buy 1-Phenyl-3,3-diethylpentyne?
You can request a quote for 1-Phenyl-3,3-diethylpentyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3,3-diethylpentyne?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3,3-diethylpentyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.