(chloro(5-oxo-2h-furan-3-yl)methyl) Acetate
TL;DR: (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate (CAS 125973-98-0) is a chemical compound with molecular formula C7H7ClO4 and molecular weight 190.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[chloro-(5-oxo-2H-furan-3-yl)methyl] acetate
Also Known As: ILVDSUQKKNCONG-UHFFFAOYSA-, (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate, [chloro-(5-oxo-2H-furan-3-yl)methyl] acetate, 2(5H)-Furanone, 4-[(acetyloxy)chloromethyl]-, 2(5H)-Furanone,4-[(acetyloxy)chloromethyl]
| Molecular Formula | C7H7ClO4 |
|---|---|
| Molecular Weight | 190.00 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.00328 |
| Heavy Atoms | 12 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 125973-98-0 |
|---|---|
| SMILES | CC(=O)OC(C1=CC(=O)OC1)Cl |
| InChIKey | ILVDSUQKKNCONG-UHFFFAOYSA-N |
Product Overview
(chloro(5-oxo-2h-furan-3-yl)methyl) Acetate (CAS 125973-98-0), with molecular formula C7H7ClO4 and molecular weight 190.00 g/mol. IUPAC: [chloro-(5-oxo-2H-furan-3-yl)methyl] acetate.
Chemical Property Profile of (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate
Property Insights of (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate. With a topological polar surface area (TPSA) of 52.6 Ų, (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate 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 (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate?
The CAS number of (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate is 125973-98-0.
What is the molecular formula of (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate?
The molecular formula of (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate is C7H7ClO4.
What is the molecular weight of (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate?
The molecular weight of (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate is 190.00 g/mol.
Where can I buy (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate?
You can request a quote for (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate?
Yes, KEHONG BIO provides custom synthesis services for (chloro(5-oxo-2h-furan-3-yl)methyl) Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.