1-(1,3-Benzodioxol-5-yl)pentan-1-ol
TL;DR: 1-(1,3-Benzodioxol-5-yl)pentan-1-ol (CAS 1015-84-5) is a chemical compound with molecular formula C12H16O3 and molecular weight 208.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(1,3-benzodioxol-5-yl)pentan-1-ol
Also Known As: a-Butylpiperonyl alcohol, alpha-Butylpiperonyl Alcohol, 1-(1,3-benzodioxol-5-yl)pentan-1-ol, KST-1A9549, 1-(1,3-Benzodioxol-5-yl)-1-pentanol
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H16O3 |
| Molecular Weight | 208.10994 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.10994 Da |
| Heavy Atoms | 15 |
| Complexity | 195.0 |
| SMILES | CCCCC(C1=CC2=C(C=C1)OCO2)O |
| InChIKey | HVIYWLGVHHVGKB-UHFFFAOYSA-N |
Chemical Property Profile of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol
Property Insights of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1,3-Benzodioxol-5-yl)pentan-1-ol. With a topological polar surface area (TPSA) of 38.7 Ų, 1-(1,3-Benzodioxol-5-yl)pentan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1,3-Benzodioxol-5-yl)pentan-1-ol 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
What is the CAS number of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol?
The CAS number of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol is 1015-84-5.
What is the molecular formula of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol?
The molecular formula of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol is C12H16O3.
What is the molecular weight of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol?
The molecular weight of 1-(1,3-Benzodioxol-5-yl)pentan-1-ol is 208.10994 g/mol.
Where can I buy 1-(1,3-Benzodioxol-5-yl)pentan-1-ol?
You can request a quote for 1-(1,3-Benzodioxol-5-yl)pentan-1-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(1,3-Benzodioxol-5-yl)pentan-1-ol?
Yes, CoreyChem provides custom synthesis services for 1-(1,3-Benzodioxol-5-yl)pentan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.