(1-Tetrahydro-3-furanyl)-1,4-pentanedione
TL;DR: (1-Tetrahydro-3-furanyl)-1,4-pentanedione (CAS 51936-77-7) is a chemical compound with molecular formula C9H14O3 and molecular weight 170.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(oxolan-3-yl)pentane-1,4-dione
Also Known As: 1-(3-Furanyl)-1,4-pentanediol, 1-(oxolan-3-yl)pentane-1,4-dione, (1-Tetrahydro-3-furanyl)-1,4-pentanedione, 1,4-Pentanedione, (1-tetrahydro-3-furanyl)-
| Molecular Formula | C9H14O3 |
|---|---|
| Molecular Weight | 170.09 g/mol |
| LogP | 0.9612 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.0943 |
| Heavy Atoms | 12 |
| Complexity | 180.21266 |
Chemical Identifiers
| CAS Number | 51936-77-7 |
|---|---|
| SMILES | CC(=O)CCC(=O)C1CCOC1 |
Product Overview
(1-Tetrahydro-3-furanyl)-1,4-pentanedione (CAS 51936-77-7), with molecular formula C9H14O3 and molecular weight 170.09 g/mol. IUPAC: 1-(oxolan-3-yl)pentane-1,4-dione.
Chemical Property Profile of (1-Tetrahydro-3-furanyl)-1,4-pentanedione
Property Insights of (1-Tetrahydro-3-furanyl)-1,4-pentanedione
The XLogP value of 0.9612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Tetrahydro-3-furanyl)-1,4-pentanedione. With a topological polar surface area (TPSA) of 43.37 Ų, (1-Tetrahydro-3-furanyl)-1,4-pentanedione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Tetrahydro-3-furanyl)-1,4-pentanedione 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 (1-Tetrahydro-3-furanyl)-1,4-pentanedione?
The CAS number of (1-Tetrahydro-3-furanyl)-1,4-pentanedione is 51936-77-7.
What is the molecular formula of (1-Tetrahydro-3-furanyl)-1,4-pentanedione?
The molecular formula of (1-Tetrahydro-3-furanyl)-1,4-pentanedione is C9H14O3.
What is the molecular weight of (1-Tetrahydro-3-furanyl)-1,4-pentanedione?
The molecular weight of (1-Tetrahydro-3-furanyl)-1,4-pentanedione is 170.09 g/mol.
Where can I buy (1-Tetrahydro-3-furanyl)-1,4-pentanedione?
You can request a quote for (1-Tetrahydro-3-furanyl)-1,4-pentanedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1-Tetrahydro-3-furanyl)-1,4-pentanedione?
Yes, KEHONG BIO provides custom synthesis services for (1-Tetrahydro-3-furanyl)-1,4-pentanedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.