CID 76049
TL;DR: CID 76049 (CAS 2806-56-6) is a chemical compound with molecular formula C6H8 and molecular weight 80.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hex-3-en-1-yne
Also Known As: Ethylvinylacetylene, 3-Hexen-1-yne, 3-Hexen-1-yne, (3E)-
| Molecular Formula | C6H8 |
|---|---|
| Molecular Weight | 80.06 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 80.0626 |
| Heavy Atoms | 6 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 2806-56-6 |
|---|---|
| SMILES | CCC=CC#C |
| InChIKey | CLFYLNSQRWCJAY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CID 76049 (CAS 2806-56-6), with molecular formula C6H8 and molecular weight 80.06 g/mol. IUPAC: hex-3-en-1-yne.
Chemical Property Profile of CID 76049
Property Insights of CID 76049
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CID 76049. With a topological polar surface area (TPSA) of 0.0 Ų, CID 76049 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CID 76049 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 CID 76049?
The CAS number of CID 76049 is 2806-56-6.
What is the molecular formula of CID 76049?
The molecular formula of CID 76049 is C6H8.
What is the molecular weight of CID 76049?
The molecular weight of CID 76049 is 80.06 g/mol.
Where can I buy CID 76049?
You can request a quote for CID 76049 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CID 76049?
Yes, KEHONG BIO provides custom synthesis services for CID 76049 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.