1-Pentyne, 3-methylene-
TL;DR: 1-Pentyne, 3-methylene- (CAS 1574-34-1) 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.
3-methylidenepent-1-yne
Also Known As: 3-Methylenepent-1-yne, 3-Methylene-1-pentyne, 3-methylidenepent-1-yne, 1-Pentyne, 3-methylene-, 2-ethylbut-1-en-3-yne
| Molecular Formula | C6H8 |
|---|---|
| Molecular Weight | 80.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 80.0626 |
| Heavy Atoms | 6 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 1574-34-1 |
|---|---|
| SMILES | CCC(=C)C#C |
| InChIKey | LAKYCCVWZNCNIO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Pentyne, 3-methylene- (CAS 1574-34-1), with molecular formula C6H8 and molecular weight 80.06 g/mol. IUPAC: 3-methylidenepent-1-yne.
Chemical Property Profile of 1-Pentyne, 3-methylene-
Property Insights of 1-Pentyne, 3-methylene-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pentyne, 3-methylene-. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Pentyne, 3-methylene- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pentyne, 3-methylene- 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 1-Pentyne, 3-methylene-?
The CAS number of 1-Pentyne, 3-methylene- is 1574-34-1.
What is the molecular formula of 1-Pentyne, 3-methylene-?
The molecular formula of 1-Pentyne, 3-methylene- is C6H8.
What is the molecular weight of 1-Pentyne, 3-methylene-?
The molecular weight of 1-Pentyne, 3-methylene- is 80.06 g/mol.
Where can I buy 1-Pentyne, 3-methylene-?
You can request a quote for 1-Pentyne, 3-methylene- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pentyne, 3-methylene-?
Yes, KEHONG BIO provides custom synthesis services for 1-Pentyne, 3-methylene- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.