4-乙酰氧基-3-戊基四氢吡喃
TL;DR: 4-乙酰氧基-3-戊基四氢吡喃 (CAS 18871-14-2) is a chemical compound with molecular formula C12H22O3 and molecular weight 214.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-乙酰氧基-3-戊基四氢吡喃
(3-pentyloxan-4-yl) acetate
Also Known As: Jasmopyrane, Jasmal, Jasmophyll, (3-pentyloxan-4-yl) acetate, Tetrahydro-3-pentyl-2H-pyran-4-yl acetate
| Molecular Formula | C12H22O3 |
|---|---|
| Molecular Weight | 214.16 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 214.15689 |
| Heavy Atoms | 15 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 18871-14-2 |
|---|---|
| SMILES | CCCCCC1COCCC1OC(=O)C |
| InChIKey | VSRVCSJJKWDZSH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-乙酰氧基-3-戊基四氢吡喃 (CAS 18871-14-2), with molecular formula C12H22O3 and molecular weight 214.16 g/mol. IUPAC: (3-pentyloxan-4-yl) acetate.
Chemical Property Profile of 4-乙酰氧基-3-戊基四氢吡喃
Property Insights of 4-乙酰氧基-3-戊基四氢吡喃
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-乙酰氧基-3-戊基四氢吡喃. With a topological polar surface area (TPSA) of 35.5 Ų, 4-乙酰氧基-3-戊基四氢吡喃 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-乙酰氧基-3-戊基四氢吡喃 has 0 hydrogen bond donor(s) and 3 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 4-乙酰氧基-3-戊基四氢吡喃?
The CAS number of 4-乙酰氧基-3-戊基四氢吡喃 is 18871-14-2.
What is the molecular formula of 4-乙酰氧基-3-戊基四氢吡喃?
The molecular formula of 4-乙酰氧基-3-戊基四氢吡喃 is C12H22O3.
What is the molecular weight of 4-乙酰氧基-3-戊基四氢吡喃?
The molecular weight of 4-乙酰氧基-3-戊基四氢吡喃 is 214.16 g/mol.
Where can I buy 4-乙酰氧基-3-戊基四氢吡喃?
You can request a quote for 4-乙酰氧基-3-戊基四氢吡喃 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-乙酰氧基-3-戊基四氢吡喃?
Yes, KEHONG BIO provides custom synthesis services for 4-乙酰氧基-3-戊基四氢吡喃 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.