Oxolan-2-ylmethyl 3-chloropropanoate
TL;DR: Oxolan-2-ylmethyl 3-chloropropanoate (CAS 4647-34-1) is a chemical compound with molecular formula C8H13ClO3 and molecular weight 192.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
oxolan-2-ylmethyl 3-chloropropanoate
Also Known As: oxolan-2-ylmethyl 3-chloropropanoate, (Oxolan-2-yl)methyl 3-chloropropanoate, Tetrahydro-2-furanylmethyl 3-chloropropanoate, (tetrahydrofuran-2-yl)methyl 3-chloropropanoate, Tetrahydro-2-furanylmethyl 3-chloropropanoate #
| Molecular Formula | C8H13ClO3 |
|---|---|
| Molecular Weight | 192.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.05533 |
| Heavy Atoms | 12 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 4647-34-1 |
|---|---|
| SMILES | C1CC(OC1)COC(=O)CCCl |
| InChIKey | GOKMPKJTXRTDFE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxolan-2-ylmethyl 3-chloropropanoate (CAS 4647-34-1), with molecular formula C8H13ClO3 and molecular weight 192.06 g/mol. IUPAC: oxolan-2-ylmethyl 3-chloropropanoate.
Chemical Property Profile of Oxolan-2-ylmethyl 3-chloropropanoate
Property Insights of Oxolan-2-ylmethyl 3-chloropropanoate
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxolan-2-ylmethyl 3-chloropropanoate. With a topological polar surface area (TPSA) of 35.5 Ų, Oxolan-2-ylmethyl 3-chloropropanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxolan-2-ylmethyl 3-chloropropanoate has 0 hydrogen bond donor(s) and 3 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 Oxolan-2-ylmethyl 3-chloropropanoate?
The CAS number of Oxolan-2-ylmethyl 3-chloropropanoate is 4647-34-1.
What is the molecular formula of Oxolan-2-ylmethyl 3-chloropropanoate?
The molecular formula of Oxolan-2-ylmethyl 3-chloropropanoate is C8H13ClO3.
What is the molecular weight of Oxolan-2-ylmethyl 3-chloropropanoate?
The molecular weight of Oxolan-2-ylmethyl 3-chloropropanoate is 192.06 g/mol.
Where can I buy Oxolan-2-ylmethyl 3-chloropropanoate?
You can request a quote for Oxolan-2-ylmethyl 3-chloropropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxolan-2-ylmethyl 3-chloropropanoate?
Yes, KEHONG BIO provides custom synthesis services for Oxolan-2-ylmethyl 3-chloropropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.