2(5H)-Furanone, 4-benzyl-
TL;DR: 2(5H)-Furanone, 4-benzyl- (CAS 16720-76-6) is a chemical compound with molecular formula C11H10O2 and molecular weight 174.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzyl-2H-furan-5-one
Also Known As: Benzylbutenolid, Benzylbutenolide, 4-Benzyl-2(5H)-furanone, 3-benzyl-2H-furan-5-one, 4-benzylfuran-2(5H)-one
| Molecular Formula | C11H10O2 |
|---|---|
| Molecular Weight | 174.07 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 174.06808 |
| Heavy Atoms | 13 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 16720-76-6 |
|---|---|
| SMILES | C1C(=CC(=O)O1)CC2=CC=CC=C2 |
| InChIKey | NDSRBOXPULNFLZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2(5H)-Furanone, 4-benzyl- (CAS 16720-76-6), with molecular formula C11H10O2 and molecular weight 174.07 g/mol. IUPAC: 3-benzyl-2H-furan-5-one.
Chemical Property Profile of 2(5H)-Furanone, 4-benzyl-
Property Insights of 2(5H)-Furanone, 4-benzyl-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2(5H)-Furanone, 4-benzyl-. With a topological polar surface area (TPSA) of 26.3 Ų, 2(5H)-Furanone, 4-benzyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2(5H)-Furanone, 4-benzyl- 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(5H)-Furanone, 4-benzyl-?
The CAS number of 2(5H)-Furanone, 4-benzyl- is 16720-76-6.
What is the molecular formula of 2(5H)-Furanone, 4-benzyl-?
The molecular formula of 2(5H)-Furanone, 4-benzyl- is C11H10O2.
What is the molecular weight of 2(5H)-Furanone, 4-benzyl-?
The molecular weight of 2(5H)-Furanone, 4-benzyl- is 174.07 g/mol.
Where can I buy 2(5H)-Furanone, 4-benzyl-?
You can request a quote for 2(5H)-Furanone, 4-benzyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(5H)-Furanone, 4-benzyl-?
Yes, KEHONG BIO provides custom synthesis services for 2(5H)-Furanone, 4-benzyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.