3-Chloropropionyl chloride
TL;DR: 3-Chloropropionyl chloride (CAS 625-36-5) is a chemical compound with molecular formula C3H4Cl2O and molecular weight 125.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloropropanoyl chloride
Also Known As: 3-Chloropropionyl chloride, 3-Chloropropanoyl chloride, Propanoyl chloride, 3-chloro-, 3-chloropropionylchloride, 3-chlorpropanoylchlorid
| Molecular Formula | C3H4Cl2O |
|---|---|
| Molecular Weight | 125.96 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 125.96392 |
| Heavy Atoms | 6 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 625-36-5 |
|---|---|
| SMILES | C(CCl)C(=O)Cl |
| InChIKey | INUNLMUAPJVRME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Chloropropionyl chloride (CAS 625-36-5), with molecular formula C3H4Cl2O and molecular weight 125.96 g/mol. IUPAC: 3-chloropropanoyl chloride.
Chemical Property Profile of 3-Chloropropionyl chloride
Property Insights of 3-Chloropropionyl chloride
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloropropionyl chloride. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Chloropropionyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Chloropropionyl chloride has 0 hydrogen bond donor(s) and 1 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-Chloropropionyl chloride?
The CAS number of 3-Chloropropionyl chloride is 625-36-5.
What is the molecular formula of 3-Chloropropionyl chloride?
The molecular formula of 3-Chloropropionyl chloride is C3H4Cl2O.
What is the molecular weight of 3-Chloropropionyl chloride?
The molecular weight of 3-Chloropropionyl chloride is 125.96 g/mol.
Where can I buy 3-Chloropropionyl chloride?
You can request a quote for 3-Chloropropionyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloropropionyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloropropionyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.