4-(4-Methoxycarbonylbutyl)-4-butanolide
TL;DR: 4-(4-Methoxycarbonylbutyl)-4-butanolide (CAS 2096434-33-0) is a chemical compound with molecular formula C10H16O4 and molecular weight 200.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-(5-oxooxolan-2-yl)pentanoate
Also Known As: 4-(4-Methoxycarbonylbutyl)-4-butanolide, methyl 5-(5-oxooxolan-2-yl)pentanoate, methyl 5-(5-oxotetrahydrofuran-2-yl)pentanoate, Methyl 5-(5-oxotetrahydro-2-furanyl)pentanoate #, 2-aFuranpentanoic acid, tetrahydro-a5-aoxo-a, methyl ester
| Molecular Formula | C10H16O4 |
|---|---|
| Molecular Weight | 200.10 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 200.10486 |
| Heavy Atoms | 14 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 2096434-33-0 |
|---|---|
| SMILES | COC(=O)CCCCC1CCC(=O)O1 |
| InChIKey | NHOSZCDEEPFDAS-UHFFFAOYSA-N |
Product Overview
4-(4-Methoxycarbonylbutyl)-4-butanolide (CAS 2096434-33-0), with molecular formula C10H16O4 and molecular weight 200.10 g/mol. IUPAC: methyl 5-(5-oxooxolan-2-yl)pentanoate.
Chemical Property Profile of 4-(4-Methoxycarbonylbutyl)-4-butanolide
Property Insights of 4-(4-Methoxycarbonylbutyl)-4-butanolide
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-Methoxycarbonylbutyl)-4-butanolide. With a topological polar surface area (TPSA) of 52.6 Ų, 4-(4-Methoxycarbonylbutyl)-4-butanolide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-Methoxycarbonylbutyl)-4-butanolide has 0 hydrogen bond donor(s) and 4 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 4-(4-Methoxycarbonylbutyl)-4-butanolide?
The CAS number of 4-(4-Methoxycarbonylbutyl)-4-butanolide is 2096434-33-0.
What is the molecular formula of 4-(4-Methoxycarbonylbutyl)-4-butanolide?
The molecular formula of 4-(4-Methoxycarbonylbutyl)-4-butanolide is C10H16O4.
What is the molecular weight of 4-(4-Methoxycarbonylbutyl)-4-butanolide?
The molecular weight of 4-(4-Methoxycarbonylbutyl)-4-butanolide is 200.10 g/mol.
Where can I buy 4-(4-Methoxycarbonylbutyl)-4-butanolide?
You can request a quote for 4-(4-Methoxycarbonylbutyl)-4-butanolide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-Methoxycarbonylbutyl)-4-butanolide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-Methoxycarbonylbutyl)-4-butanolide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.