3-Methylpent-2-en-1-ol
TL;DR: 3-Methylpent-2-en-1-ol (CAS 30801-95-7) is a chemical compound with molecular formula C6H12O and molecular weight 100.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methylpent-2-en-1-ol
Also Known As: 3-methylpent-2-en-1-ol, 3-Methyl-2-pentenol, 2-Penten-1-ol,3-methyl-, 2-Penten-1-ol, 3-methyl-, (Z)-, 2-Penten-1-ol, 3-methyl-, (E)-
| Molecular Formula | C6H12O |
|---|---|
| Molecular Weight | 100.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 100.08881 |
| Heavy Atoms | 7 |
| Complexity | 64.0 |
Chemical Identifiers
| CAS Number | 30801-95-7 |
|---|---|
| SMILES | CCC(=CCO)C |
| InChIKey | QFXSWGXWZXSGLC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methylpent-2-en-1-ol (CAS 30801-95-7), with molecular formula C6H12O and molecular weight 100.09 g/mol. IUPAC: 3-methylpent-2-en-1-ol.
Chemical Property Profile of 3-Methylpent-2-en-1-ol
Property Insights of 3-Methylpent-2-en-1-ol
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methylpent-2-en-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Methylpent-2-en-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methylpent-2-en-1-ol has 1 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-Methylpent-2-en-1-ol?
The CAS number of 3-Methylpent-2-en-1-ol is 30801-95-7.
What is the molecular formula of 3-Methylpent-2-en-1-ol?
The molecular formula of 3-Methylpent-2-en-1-ol is C6H12O.
What is the molecular weight of 3-Methylpent-2-en-1-ol?
The molecular weight of 3-Methylpent-2-en-1-ol is 100.09 g/mol.
Where can I buy 3-Methylpent-2-en-1-ol?
You can request a quote for 3-Methylpent-2-en-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methylpent-2-en-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-Methylpent-2-en-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.