Chloromethyl propionate
TL;DR: Chloromethyl propionate (CAS 61466-44-2) is a chemical compound with molecular formula C4H7ClO2 and molecular weight 122.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
chloromethyl propanoate
Also Known As: Chloromethyl propionate, Chloromethyl propanoate, chloromethylpropionate, chloromethyl propanate, Clevidipine Impurity 12
| Molecular Formula | C4H7ClO2 |
|---|---|
| Molecular Weight | 122.01 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 122.01346 |
| Heavy Atoms | 7 |
| Complexity | 62.0 |
Chemical Identifiers
| CAS Number | 61466-44-2 |
|---|---|
| SMILES | CCC(=O)OCCl |
| InChIKey | BTBBPNVBJSIADI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chloromethyl propionate (CAS 61466-44-2), with molecular formula C4H7ClO2 and molecular weight 122.01 g/mol. IUPAC: chloromethyl propanoate.
Chemical Property Profile of Chloromethyl propionate
Property Insights of Chloromethyl propionate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Chloromethyl propionate. With a topological polar surface area (TPSA) of 26.3 Ų, Chloromethyl propionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chloromethyl propionate 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 Chloromethyl propionate?
The CAS number of Chloromethyl propionate is 61466-44-2.
What is the molecular formula of Chloromethyl propionate?
The molecular formula of Chloromethyl propionate is C4H7ClO2.
What is the molecular weight of Chloromethyl propionate?
The molecular weight of Chloromethyl propionate is 122.01 g/mol.
Where can I buy Chloromethyl propionate?
You can request a quote for Chloromethyl propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chloromethyl propionate?
Yes, KEHONG BIO provides custom synthesis services for Chloromethyl propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.