(3,4-Dichlorophenyl)methyl propanoate
TL;DR: (3,4-Dichlorophenyl)methyl propanoate (CAS 85263-01-0) is a chemical compound with molecular formula C10H10Cl2O2 and molecular weight 232.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,4-dichlorophenyl)methyl propanoate
Also Known As: (3,4-dichlorophenyl)methyl propanoate
| Molecular Formula | C10H10Cl2O2 |
|---|---|
| Molecular Weight | 232.01 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 232.00578 |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 85263-01-0 |
|---|---|
| SMILES | CCC(=O)OCC1=CC(=C(C=C1)Cl)Cl |
| InChIKey | PUVVYQAJJXXUAB-UHFFFAOYSA-N |
Product Overview
(3,4-Dichlorophenyl)methyl propanoate (CAS 85263-01-0), with molecular formula C10H10Cl2O2 and molecular weight 232.01 g/mol. IUPAC: (3,4-dichlorophenyl)methyl propanoate.
Chemical Property Profile of (3,4-Dichlorophenyl)methyl propanoate
Property Insights of (3,4-Dichlorophenyl)methyl propanoate
The XLogP value of 3.3 indicates that (3,4-Dichlorophenyl)methyl propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (3,4-Dichlorophenyl)methyl propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3,4-Dichlorophenyl)methyl propanoate 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 (3,4-Dichlorophenyl)methyl propanoate?
The CAS number of (3,4-Dichlorophenyl)methyl propanoate is 85263-01-0.
What is the molecular formula of (3,4-Dichlorophenyl)methyl propanoate?
The molecular formula of (3,4-Dichlorophenyl)methyl propanoate is C10H10Cl2O2.
What is the molecular weight of (3,4-Dichlorophenyl)methyl propanoate?
The molecular weight of (3,4-Dichlorophenyl)methyl propanoate is 232.01 g/mol.
Where can I buy (3,4-Dichlorophenyl)methyl propanoate?
You can request a quote for (3,4-Dichlorophenyl)methyl propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,4-Dichlorophenyl)methyl propanoate?
Yes, KEHONG BIO provides custom synthesis services for (3,4-Dichlorophenyl)methyl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.