2-Butanoyl-5-methylfuran
TL;DR: 2-Butanoyl-5-methylfuran (CAS 90673-55-5) is a chemical compound with molecular formula C9H12O2 and molecular weight 152.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-methylfuran-2-yl)butan-1-one
Also Known As: 2-Butanoyl-5-methylfuran, 1-(5-methylfuran-2-yl)butan-1-one, 5-Methyl-2-butyrylfuran, 1-(5-Methyl-[2]furyl)-butan-1-on, 1-(5-Methyl-2-furyl)-1-butanone #
| Molecular Formula | C9H12O2 |
|---|---|
| Molecular Weight | 152.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 152.08372 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 90673-55-5 |
|---|---|
| SMILES | CCCC(=O)C1=CC=C(O1)C |
| InChIKey | IFHKZUYQKMDHIN-UHFFFAOYSA-N |
Product Overview
2-Butanoyl-5-methylfuran (CAS 90673-55-5), with molecular formula C9H12O2 and molecular weight 152.08 g/mol. IUPAC: 1-(5-methylfuran-2-yl)butan-1-one.
Chemical Property Profile of 2-Butanoyl-5-methylfuran
Property Insights of 2-Butanoyl-5-methylfuran
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butanoyl-5-methylfuran. With a topological polar surface area (TPSA) of 30.2 Ų, 2-Butanoyl-5-methylfuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanoyl-5-methylfuran 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-Butanoyl-5-methylfuran?
The CAS number of 2-Butanoyl-5-methylfuran is 90673-55-5.
What is the molecular formula of 2-Butanoyl-5-methylfuran?
The molecular formula of 2-Butanoyl-5-methylfuran is C9H12O2.
What is the molecular weight of 2-Butanoyl-5-methylfuran?
The molecular weight of 2-Butanoyl-5-methylfuran is 152.08 g/mol.
Where can I buy 2-Butanoyl-5-methylfuran?
You can request a quote for 2-Butanoyl-5-methylfuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butanoyl-5-methylfuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Butanoyl-5-methylfuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.