2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-
TL;DR: 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- (CAS 31704-82-2) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-4-(5-methylfuran-2-yl)pentan-2-one
Also Known As: 4-Methyl-4-(5-methyl-2-furyl)pentan-2-one, 4-methyl-4-(5-methylfuran-2-yl)pentan-2-one, EINECS 250-773-5, 4-methyl-4- pentan-2-one, 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-
| Molecular Formula | C11H16O2 |
|---|---|
| Molecular Weight | 180.12 g/mol |
| LogP | 2.84472 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.11504 |
| Heavy Atoms | 13 |
| Complexity | 307.6451 |
Chemical Identifiers
| CAS Number | 31704-82-2 |
|---|---|
| SMILES | CC1=CC=C(O1)C(C)(C)CC(=O)C |
Product Overview
2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- (CAS 31704-82-2), with molecular formula C11H16O2 and molecular weight 180.12 g/mol. IUPAC: 4-methyl-4-(5-methylfuran-2-yl)pentan-2-one.
Chemical Property Profile of 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-
Property Insights of 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-
The XLogP value of 2.84472 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-. With a topological polar surface area (TPSA) of 30.21 Ų, 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- has 0 hydrogen bond donor(s) and 2 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 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-?
The CAS number of 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- is 31704-82-2.
What is the molecular formula of 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-?
The molecular formula of 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- is C11H16O2.
What is the molecular weight of 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-?
The molecular weight of 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- is 180.12 g/mol.
Where can I buy 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-?
You can request a quote for 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentanone, 4-methyl-4-(5-methyl-2-furanyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.