(3-Acetyloxy-2-chloroprop-2-enyl) acetate
TL;DR: (3-Acetyloxy-2-chloroprop-2-enyl) acetate (CAS 10118-72-6) is a chemical compound with molecular formula C7H9ClO4 and molecular weight 192.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-acetyloxy-2-chloroprop-2-enyl) acetate
Also Known As: [(Z)-3-acetyloxy-2-chloroprop-2-enyl] acetate
| Molecular Formula | C7H9ClO4 |
|---|---|
| Molecular Weight | 192.02 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.01894 |
| Heavy Atoms | 12 |
| Complexity | 209.0 |
Chemical Identifiers
| CAS Number | 10118-72-6 |
|---|---|
| SMILES | CC(=O)OCC(=COC(=O)C)Cl |
| InChIKey | GEEGHNOKMUVQRF-UHFFFAOYSA-N |
Product Overview
(3-Acetyloxy-2-chloroprop-2-enyl) acetate (CAS 10118-72-6), with molecular formula C7H9ClO4 and molecular weight 192.02 g/mol. IUPAC: (3-acetyloxy-2-chloroprop-2-enyl) acetate.
Chemical Property Profile of (3-Acetyloxy-2-chloroprop-2-enyl) acetate
Property Insights of (3-Acetyloxy-2-chloroprop-2-enyl) acetate
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Acetyloxy-2-chloroprop-2-enyl) acetate. With a topological polar surface area (TPSA) of 52.6 Ų, (3-Acetyloxy-2-chloroprop-2-enyl) acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Acetyloxy-2-chloroprop-2-enyl) 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 (3-Acetyloxy-2-chloroprop-2-enyl) acetate?
The CAS number of (3-Acetyloxy-2-chloroprop-2-enyl) acetate is 10118-72-6.
What is the molecular formula of (3-Acetyloxy-2-chloroprop-2-enyl) acetate?
The molecular formula of (3-Acetyloxy-2-chloroprop-2-enyl) acetate is C7H9ClO4.
What is the molecular weight of (3-Acetyloxy-2-chloroprop-2-enyl) acetate?
The molecular weight of (3-Acetyloxy-2-chloroprop-2-enyl) acetate is 192.02 g/mol.
Where can I buy (3-Acetyloxy-2-chloroprop-2-enyl) acetate?
You can request a quote for (3-Acetyloxy-2-chloroprop-2-enyl) acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Acetyloxy-2-chloroprop-2-enyl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (3-Acetyloxy-2-chloroprop-2-enyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.