1-Methylcyclobutanol
TL;DR: 1-Methylcyclobutanol (CAS 20117-47-9) is a chemical compound with molecular formula C5H10O and molecular weight 86.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methylcyclobutan-1-ol
Also Known As: 1-Methylcyclobutanol, 1-methylcyclobutan-1-ol, cyclobutanol, 1-methyl-, 1-methyl-cyclobutanol, Cyclobutanol,1-methyl-
| Molecular Formula | C5H10O |
|---|---|
| Molecular Weight | 86.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 86.073166 |
| Heavy Atoms | 6 |
| Complexity | 55.0 |
Chemical Identifiers
| CAS Number | 20117-47-9 |
|---|---|
| SMILES | CC1(CCC1)O |
| InChIKey | DQWVUKFABWSFJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methylcyclobutanol (CAS 20117-47-9), with molecular formula C5H10O and molecular weight 86.07 g/mol. IUPAC: 1-methylcyclobutan-1-ol.
Chemical Property Profile of 1-Methylcyclobutanol
Property Insights of 1-Methylcyclobutanol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methylcyclobutanol. With a topological polar surface area (TPSA) of 20.2 Ų, 1-Methylcyclobutanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methylcyclobutanol 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 1-Methylcyclobutanol?
The CAS number of 1-Methylcyclobutanol is 20117-47-9.
What is the molecular formula of 1-Methylcyclobutanol?
The molecular formula of 1-Methylcyclobutanol is C5H10O.
What is the molecular weight of 1-Methylcyclobutanol?
The molecular weight of 1-Methylcyclobutanol is 86.07 g/mol.
Where can I buy 1-Methylcyclobutanol?
You can request a quote for 1-Methylcyclobutanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methylcyclobutanol?
Yes, KEHONG BIO provides custom synthesis services for 1-Methylcyclobutanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.