3-Methylpentyne-3,4-diol
TL;DR: 3-Methylpentyne-3,4-diol (CAS 62386-32-7) is a chemical compound with molecular formula C6H10O2 and molecular weight 114.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylpent-4-yne-2,3-diol
Also Known As: 3-Methylpentyne-3,4-diol, 3-methylpent-4-yne-2,3-diol, 3-Methylpentyn-3,4-diol, 4-Pentyne-2,3-diol, 3-methyl-, RefChem:94950
| Molecular Formula | C6H10O2 |
|---|---|
| Molecular Weight | 114.07 g/mol |
| LogP | -0.2486 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 114.06808 |
| Heavy Atoms | 8 |
| Complexity | 108.187164 |
Chemical Identifiers
| CAS Number | 62386-32-7 |
|---|---|
| SMILES | CC(C(C)(C#C)O)O |
Product Overview
3-Methylpentyne-3,4-diol (CAS 62386-32-7), with molecular formula C6H10O2 and molecular weight 114.07 g/mol. IUPAC: 3-methylpent-4-yne-2,3-diol.
Chemical Property Profile of 3-Methylpentyne-3,4-diol
Property Insights of 3-Methylpentyne-3,4-diol
The XLogP value of -0.2486 indicates that 3-Methylpentyne-3,4-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.46 Ų, 3-Methylpentyne-3,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylpentyne-3,4-diol has 2 hydrogen bond donor(s) and 2 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-Methylpentyne-3,4-diol?
The CAS number of 3-Methylpentyne-3,4-diol is 62386-32-7.
What is the molecular formula of 3-Methylpentyne-3,4-diol?
The molecular formula of 3-Methylpentyne-3,4-diol is C6H10O2.
What is the molecular weight of 3-Methylpentyne-3,4-diol?
The molecular weight of 3-Methylpentyne-3,4-diol is 114.07 g/mol.
Where can I buy 3-Methylpentyne-3,4-diol?
You can request a quote for 3-Methylpentyne-3,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylpentyne-3,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylpentyne-3,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.