4-Methyl-1-pentyne
TL;DR: 4-Methyl-1-pentyne (CAS 7154-75-8) is a chemical compound with molecular formula C6H10 and molecular weight 82.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylpent-1-yne
Also Known As: 4-Methyl-1-pentyne, 4-methylpent-1-yne, Isobutylacetylene, Isobutylethyne, 1-Pentyne, 4-methyl-
| Molecular Formula | C6H10 |
|---|---|
| Molecular Weight | 82.08 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 82.07825 |
| Heavy Atoms | 6 |
| Complexity | 61.0 |
Chemical Identifiers
| CAS Number | 7154-75-8 |
|---|---|
| SMILES | CC(C)CC#C |
| InChIKey | OXRWICUICBZVAE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methyl-1-pentyne (CAS 7154-75-8), with molecular formula C6H10 and molecular weight 82.08 g/mol. IUPAC: 4-methylpent-1-yne.
Chemical Property Profile of 4-Methyl-1-pentyne
Property Insights of 4-Methyl-1-pentyne
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methyl-1-pentyne. With a topological polar surface area (TPSA) of 0.0 Ų, 4-Methyl-1-pentyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methyl-1-pentyne 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 4-Methyl-1-pentyne?
The CAS number of 4-Methyl-1-pentyne is 7154-75-8.
What is the molecular formula of 4-Methyl-1-pentyne?
The molecular formula of 4-Methyl-1-pentyne is C6H10.
What is the molecular weight of 4-Methyl-1-pentyne?
The molecular weight of 4-Methyl-1-pentyne is 82.08 g/mol.
Where can I buy 4-Methyl-1-pentyne?
You can request a quote for 4-Methyl-1-pentyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methyl-1-pentyne?
Yes, KEHONG BIO provides custom synthesis services for 4-Methyl-1-pentyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.