2-Oxetanone, 4-methyl-3-methylene-
TL;DR: 2-Oxetanone, 4-methyl-3-methylene- (CAS 117203-16-4) is a chemical compound with molecular formula C5H6O2 and molecular weight 98.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-3-methylideneoxetan-2-one
Also Known As: 2-Oxetanone, 4-methyl-3-methylene-, 4-methyl-3-methylideneoxetan-2-one, alpha-methylene-beta-butyrolactone, 2-Oxetanone,4-methyl-3-methylene, 4-Methyl-3-methyleneoxetan-2-one
| Molecular Formula | C5H6O2 |
|---|---|
| Molecular Weight | 98.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 98.03678 |
| Heavy Atoms | 7 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 117203-16-4 |
|---|---|
| SMILES | CC1C(=C)C(=O)O1 |
| InChIKey | ABPAZYHRDOVNLH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Oxetanone, 4-methyl-3-methylene- (CAS 117203-16-4), with molecular formula C5H6O2 and molecular weight 98.04 g/mol. IUPAC: 4-methyl-3-methylideneoxetan-2-one.
Chemical Property Profile of 2-Oxetanone, 4-methyl-3-methylene-
Property Insights of 2-Oxetanone, 4-methyl-3-methylene-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Oxetanone, 4-methyl-3-methylene-. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Oxetanone, 4-methyl-3-methylene- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Oxetanone, 4-methyl-3-methylene- 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-Oxetanone, 4-methyl-3-methylene-?
The CAS number of 2-Oxetanone, 4-methyl-3-methylene- is 117203-16-4.
What is the molecular formula of 2-Oxetanone, 4-methyl-3-methylene-?
The molecular formula of 2-Oxetanone, 4-methyl-3-methylene- is C5H6O2.
What is the molecular weight of 2-Oxetanone, 4-methyl-3-methylene-?
The molecular weight of 2-Oxetanone, 4-methyl-3-methylene- is 98.04 g/mol.
Where can I buy 2-Oxetanone, 4-methyl-3-methylene-?
You can request a quote for 2-Oxetanone, 4-methyl-3-methylene- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Oxetanone, 4-methyl-3-methylene-?
Yes, KEHONG BIO provides custom synthesis services for 2-Oxetanone, 4-methyl-3-methylene- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.