二苯基丁二炔
TL;DR: 二苯基丁二炔 (CAS 886-66-8) is a chemical compound with molecular formula C16H10 and molecular weight 202.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二苯基丁二炔
4-phenylbuta-1,3-diynylbenzene
Also Known As: 1,4-Diphenylbutadiyne, Diphenyldiacetylene, Diphenylbutadiyne, 1,4-diphenylbuta-1,3-diyne, Butadiyne, diphenyl-
| Molecular Formula | C16H10 |
|---|---|
| Molecular Weight | 202.08 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.07825 |
| Heavy Atoms | 16 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 886-66-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C#CC#CC2=CC=CC=C2 |
| InChIKey | HMQFJYLWNWIYKQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二苯基丁二炔 (CAS 886-66-8), with molecular formula C16H10 and molecular weight 202.08 g/mol. IUPAC: 4-phenylbuta-1,3-diynylbenzene.
Chemical Property Profile of 二苯基丁二炔
Property Insights of 二苯基丁二炔
The XLogP value of 5.2 indicates that 二苯基丁二炔 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 二苯基丁二炔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二苯基丁二炔 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 二苯基丁二炔?
The CAS number of 二苯基丁二炔 is 886-66-8.
What is the molecular formula of 二苯基丁二炔?
The molecular formula of 二苯基丁二炔 is C16H10.
What is the molecular weight of 二苯基丁二炔?
The molecular weight of 二苯基丁二炔 is 202.08 g/mol.
Where can I buy 二苯基丁二炔?
You can request a quote for 二苯基丁二炔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二苯基丁二炔?
Yes, KEHONG BIO provides custom synthesis services for 二苯基丁二炔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.