3-Methoxypropyne
TL;DR: 3-Methoxypropyne (CAS 627-41-8) is a chemical compound with molecular formula C4H6O and molecular weight 70.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxyprop-1-yne
Also Known As: Methyl propargyl ether, 3-methoxyprop-1-yne, 3-Methoxypropyne, Methyl 2-propynyl ether, 3-Methoxy-1-propyne
| Molecular Formula | C4H6O |
|---|---|
| Molecular Weight | 70.04 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 70.04186 |
| Heavy Atoms | 5 |
| Complexity | 47.0 |
Chemical Identifiers
| CAS Number | 627-41-8 |
|---|---|
| SMILES | COCC#C |
| InChIKey | YACFFSVYSPMSGS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methoxypropyne (CAS 627-41-8), with molecular formula C4H6O and molecular weight 70.04 g/mol. IUPAC: 3-methoxyprop-1-yne.
Chemical Property Profile of 3-Methoxypropyne
Property Insights of 3-Methoxypropyne
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxypropyne. With a topological polar surface area (TPSA) of 9.2 Ų, 3-Methoxypropyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxypropyne has 0 hydrogen bond donor(s) and 1 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 3-Methoxypropyne?
The CAS number of 3-Methoxypropyne is 627-41-8.
What is the molecular formula of 3-Methoxypropyne?
The molecular formula of 3-Methoxypropyne is C4H6O.
What is the molecular weight of 3-Methoxypropyne?
The molecular weight of 3-Methoxypropyne is 70.04 g/mol.
Where can I buy 3-Methoxypropyne?
You can request a quote for 3-Methoxypropyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxypropyne?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxypropyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.