Methyl 4-hydroxy-4-methylpent-2-ynoate
TL;DR: Methyl 4-hydroxy-4-methylpent-2-ynoate (CAS 25294-59-1) is a chemical compound with molecular formula C7H10O3 and molecular weight 142.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-hydroxy-4-methylpent-2-ynoate
Also Known As: methyl 4-hydroxy-4-methylpent-2-ynoate, METHYL 4-HYDROXY-4-METHYL-2-PENTYNOATE, methyl 4-methyl-4-hydroxy-2-pentynoate, Methyl 4-hydroxy-4-methyl-pent-2-ynoate, 3-Quinolinemethanol,2-chloro-6,7-difluoro-
| Molecular Formula | C7H10O3 |
|---|---|
| Molecular Weight | 142.06 g/mol |
| LogP | -0.0663 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 142.06299 |
| Heavy Atoms | 10 |
| Complexity | 177.25346 |
Chemical Identifiers
| CAS Number | 25294-59-1 |
|---|---|
| SMILES | CC(C)(C#CC(=O)OC)O |
Product Overview
Methyl 4-hydroxy-4-methylpent-2-ynoate (CAS 25294-59-1), with molecular formula C7H10O3 and molecular weight 142.06 g/mol. IUPAC: methyl 4-hydroxy-4-methylpent-2-ynoate.
Chemical Property Profile of Methyl 4-hydroxy-4-methylpent-2-ynoate
Property Insights of Methyl 4-hydroxy-4-methylpent-2-ynoate
The XLogP value of -0.0663 indicates that Methyl 4-hydroxy-4-methylpent-2-ynoate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 46.53 Ų, Methyl 4-hydroxy-4-methylpent-2-ynoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-hydroxy-4-methylpent-2-ynoate has 1 hydrogen bond donor(s) and 3 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 Methyl 4-hydroxy-4-methylpent-2-ynoate?
The CAS number of Methyl 4-hydroxy-4-methylpent-2-ynoate is 25294-59-1.
What is the molecular formula of Methyl 4-hydroxy-4-methylpent-2-ynoate?
The molecular formula of Methyl 4-hydroxy-4-methylpent-2-ynoate is C7H10O3.
What is the molecular weight of Methyl 4-hydroxy-4-methylpent-2-ynoate?
The molecular weight of Methyl 4-hydroxy-4-methylpent-2-ynoate is 142.06 g/mol.
Where can I buy Methyl 4-hydroxy-4-methylpent-2-ynoate?
You can request a quote for Methyl 4-hydroxy-4-methylpent-2-ynoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-hydroxy-4-methylpent-2-ynoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-hydroxy-4-methylpent-2-ynoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.