Oxirane, 2-((4-chlorophenyl)methyl)-
TL;DR: Oxirane, 2-((4-chlorophenyl)methyl)- (CAS 36519-91-2) is a chemical compound with molecular formula C9H9ClO and molecular weight 168.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-chlorophenyl)methyl]oxirane
Also Known As: 2-[(4-chlorophenyl)methyl]oxirane, 4-Allylchlorobenzene oxide, p-Chlorophenylpropylene oxide, 4-Chlorobenzyloxirane, ((4-Chlorophenyl)methyl)oxirane
| Molecular Formula | C9H9ClO |
|---|---|
| Molecular Weight | 168.03 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.0342 |
| Heavy Atoms | 11 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 36519-91-2 |
|---|---|
| SMILES | C1C(O1)CC2=CC=C(C=C2)Cl |
| InChIKey | ZPEVFFRSZBVWGB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Oxirane, 2-((4-chlorophenyl)methyl)- (CAS 36519-91-2), with molecular formula C9H9ClO and molecular weight 168.03 g/mol. IUPAC: 2-[(4-chlorophenyl)methyl]oxirane.
Chemical Property Profile of Oxirane, 2-((4-chlorophenyl)methyl)-
Property Insights of Oxirane, 2-((4-chlorophenyl)methyl)-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Oxirane, 2-((4-chlorophenyl)methyl)-. With a topological polar surface area (TPSA) of 12.5 Ų, Oxirane, 2-((4-chlorophenyl)methyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxirane, 2-((4-chlorophenyl)methyl)- 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 Oxirane, 2-((4-chlorophenyl)methyl)-?
The CAS number of Oxirane, 2-((4-chlorophenyl)methyl)- is 36519-91-2.
What is the molecular formula of Oxirane, 2-((4-chlorophenyl)methyl)-?
The molecular formula of Oxirane, 2-((4-chlorophenyl)methyl)- is C9H9ClO.
What is the molecular weight of Oxirane, 2-((4-chlorophenyl)methyl)-?
The molecular weight of Oxirane, 2-((4-chlorophenyl)methyl)- is 168.03 g/mol.
Where can I buy Oxirane, 2-((4-chlorophenyl)methyl)-?
You can request a quote for Oxirane, 2-((4-chlorophenyl)methyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Oxirane, 2-((4-chlorophenyl)methyl)-?
Yes, KEHONG BIO provides custom synthesis services for Oxirane, 2-((4-chlorophenyl)methyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.