1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-
TL;DR: 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- (CAS 122666-14-2) is a chemical compound with molecular formula C16H24O3 and molecular weight 264.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(1,3-benzodioxol-5-yl)nonan-5-ol
Also Known As: 5-(1,3-Benzodioxol-5-yl)nonan-5-ol, 5-benzo[1,3]dioxol-5-ylnonan-5-ol, 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-, 5-(2H-1,3-BENZODIOXOL-5-YL)NONAN-5-OL
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C16H24O3 |
| Molecular Weight | 264.17255 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 264.17255 Da |
| Heavy Atoms | 19 |
| Complexity | 259.0 |
| SMILES | CCCCC(CCCC)(C1=CC2=C(C=C1)OCO2)O |
| InChIKey | DSSCOKPSFWCFSW-UHFFFAOYSA-N |
Chemical Property Profile of 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-
Property Insights of 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-
The XLogP value of 4.5 indicates that 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.7 Ų, 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- 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 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-?
The CAS number of 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- is 122666-14-2.
What is the molecular formula of 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-?
The molecular formula of 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- is C16H24O3.
What is the molecular weight of 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-?
The molecular weight of 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- is 264.17255 g/mol.
Where can I buy 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-?
You can request a quote for 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl-?
Yes, CoreyChem provides custom synthesis services for 1,3-Benzodioxole-5-methanol, alpha,alpha-dibutyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.