6-Phenylhex-3-en-1,5-diynylbenzene
TL;DR: 6-Phenylhex-3-en-1,5-diynylbenzene (CAS 17531-24-7) is a chemical compound with molecular formula C18H12 and molecular weight 228.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-phenylhex-3-en-1,5-diynylbenzene
Also Known As: Benzene, 1,1'-(3-hexene-1,5-diyne-1,6-diyl)bis-
| Molecular Formula | C18H12 |
|---|---|
| Molecular Weight | 228.09 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.0939 |
| Heavy Atoms | 18 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 17531-24-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC=CC#CC2=CC=CC=C2 |
| InChIKey | ZZOLVPYFGLQRQS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Phenylhex-3-en-1,5-diynylbenzene (CAS 17531-24-7), with molecular formula C18H12 and molecular weight 228.09 g/mol. IUPAC: 6-phenylhex-3-en-1,5-diynylbenzene.
Chemical Property Profile of 6-Phenylhex-3-en-1,5-diynylbenzene
Property Insights of 6-Phenylhex-3-en-1,5-diynylbenzene
The XLogP value of 5.8 indicates that 6-Phenylhex-3-en-1,5-diynylbenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 6-Phenylhex-3-en-1,5-diynylbenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Phenylhex-3-en-1,5-diynylbenzene 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 6-Phenylhex-3-en-1,5-diynylbenzene?
The CAS number of 6-Phenylhex-3-en-1,5-diynylbenzene is 17531-24-7.
What is the molecular formula of 6-Phenylhex-3-en-1,5-diynylbenzene?
The molecular formula of 6-Phenylhex-3-en-1,5-diynylbenzene is C18H12.
What is the molecular weight of 6-Phenylhex-3-en-1,5-diynylbenzene?
The molecular weight of 6-Phenylhex-3-en-1,5-diynylbenzene is 228.09 g/mol.
Where can I buy 6-Phenylhex-3-en-1,5-diynylbenzene?
You can request a quote for 6-Phenylhex-3-en-1,5-diynylbenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Phenylhex-3-en-1,5-diynylbenzene?
Yes, KEHONG BIO provides custom synthesis services for 6-Phenylhex-3-en-1,5-diynylbenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.