5-Chloromethyl-2-iminooxazoline
TL;DR: 5-Chloromethyl-2-iminooxazoline (CAS 7550-39-2) is a chemical compound with molecular formula C4H7ClN2O and molecular weight 134.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(chloromethyl)-4,5-dihydro-1,3-oxazol-2-amine
Also Known As: 5-Chloromethyl-2-iminooxazoline, 5-(chloromethyl)-4,5-dihydro-1,3-oxazol-2-amine, 5-(Chloromethyl)-4,5-dihydrooxazol-2-amine, 2-imino-5-(chloromethyl) oxazolidine-, 5-(CHLOROMETHYL)-1,3-OXAZOLIDIN-2-IMINE
| Molecular Formula | C4H7ClN2O |
|---|---|
| Molecular Weight | 134.02 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 134.02469 |
| Heavy Atoms | 8 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 7550-39-2 |
|---|---|
| SMILES | C1C(OC(=N1)N)CCl |
| InChIKey | ILLXLIKVXGHEOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Chloromethyl-2-iminooxazoline (CAS 7550-39-2), with molecular formula C4H7ClN2O and molecular weight 134.02 g/mol. IUPAC: 5-(chloromethyl)-4,5-dihydro-1,3-oxazol-2-amine.
Chemical Property Profile of 5-Chloromethyl-2-iminooxazoline
Property Insights of 5-Chloromethyl-2-iminooxazoline
The XLogP value of -0.1 indicates that 5-Chloromethyl-2-iminooxazoline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.6 Ų, 5-Chloromethyl-2-iminooxazoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloromethyl-2-iminooxazoline has 1 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 5-Chloromethyl-2-iminooxazoline?
The CAS number of 5-Chloromethyl-2-iminooxazoline is 7550-39-2.
What is the molecular formula of 5-Chloromethyl-2-iminooxazoline?
The molecular formula of 5-Chloromethyl-2-iminooxazoline is C4H7ClN2O.
What is the molecular weight of 5-Chloromethyl-2-iminooxazoline?
The molecular weight of 5-Chloromethyl-2-iminooxazoline is 134.02 g/mol.
Where can I buy 5-Chloromethyl-2-iminooxazoline?
You can request a quote for 5-Chloromethyl-2-iminooxazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloromethyl-2-iminooxazoline?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloromethyl-2-iminooxazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.