beta-Methyl-gamma-butyrolactone
TL;DR: beta-Methyl-gamma-butyrolactone (CAS 1679-49-8) is a chemical compound with molecular formula C5H8O2 and molecular weight 100.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyloxolan-2-one
Also Known As: 3-Methylbutyrolactone, 4-methyloxolan-2-one, 3-Iminosaccharin, 4-Methyldihydrofuran-2(3H)-one, 3-Methylbutanolide
| Molecular Formula | C5H8O2 |
|---|---|
| Molecular Weight | 100.05 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.05243 |
| Heavy Atoms | 7 |
| Complexity | 88.0 |
Chemical Identifiers
| CAS Number | 1679-49-8 |
|---|---|
| SMILES | CC1CC(=O)OC1 |
| InChIKey | ALZLTHLQMAFAPA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
beta-Methyl-gamma-butyrolactone (CAS 1679-49-8), with molecular formula C5H8O2 and molecular weight 100.05 g/mol. IUPAC: 4-methyloxolan-2-one.
Chemical Property Profile of beta-Methyl-gamma-butyrolactone
Property Insights of beta-Methyl-gamma-butyrolactone
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for beta-Methyl-gamma-butyrolactone. With a topological polar surface area (TPSA) of 26.3 Ų, beta-Methyl-gamma-butyrolactone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, beta-Methyl-gamma-butyrolactone 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 beta-Methyl-gamma-butyrolactone?
The CAS number of beta-Methyl-gamma-butyrolactone is 1679-49-8.
What is the molecular formula of beta-Methyl-gamma-butyrolactone?
The molecular formula of beta-Methyl-gamma-butyrolactone is C5H8O2.
What is the molecular weight of beta-Methyl-gamma-butyrolactone?
The molecular weight of beta-Methyl-gamma-butyrolactone is 100.05 g/mol.
Where can I buy beta-Methyl-gamma-butyrolactone?
You can request a quote for beta-Methyl-gamma-butyrolactone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-Methyl-gamma-butyrolactone?
Yes, KEHONG BIO provides custom synthesis services for beta-Methyl-gamma-butyrolactone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.