对氯苯基丁烯氧化物
TL;DR: 对氯苯基丁烯氧化物 (CAS 1189717-28-9) is a chemical compound with molecular formula C10H11ClO and molecular weight 182.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对氯苯基丁烯氧化物
2-[2-(4-chlorophenyl)ethyl]oxirane
Also Known As: p-Chlorophenylbutylene oxide, Butoconazole Impurity 6, 2-[2-(4-chlorophenyl)ethyl]oxirane, (2-(4-Chlorophenyl)ethyl)oxirane, Oxirane, 2-[2-(4-chlorophenyl)ethyl]-
| Molecular Formula | C10H11ClO |
|---|---|
| Molecular Weight | 182.05 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 182.04984 |
| Heavy Atoms | 12 |
| Complexity | 141.0 |
Chemical Identifiers
| CAS Number | 1189717-28-9 |
|---|---|
| SMILES | C1C(O1)CCC2=CC=C(C=C2)Cl |
| InChIKey | XGQOGVGIYGXEDR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
对氯苯基丁烯氧化物 (CAS 1189717-28-9), with molecular formula C10H11ClO and molecular weight 182.05 g/mol. IUPAC: 2-[2-(4-chlorophenyl)ethyl]oxirane.
Chemical Property Profile of 对氯苯基丁烯氧化物
Property Insights of 对氯苯基丁烯氧化物
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 对氯苯基丁烯氧化物. With a topological polar surface area (TPSA) of 12.5 Ų, 对氯苯基丁烯氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对氯苯基丁烯氧化物 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 对氯苯基丁烯氧化物?
The CAS number of 对氯苯基丁烯氧化物 is 1189717-28-9.
What is the molecular formula of 对氯苯基丁烯氧化物?
The molecular formula of 对氯苯基丁烯氧化物 is C10H11ClO.
What is the molecular weight of 对氯苯基丁烯氧化物?
The molecular weight of 对氯苯基丁烯氧化物 is 182.05 g/mol.
Where can I buy 对氯苯基丁烯氧化物?
You can request a quote for 对氯苯基丁烯氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对氯苯基丁烯氧化物?
Yes, KEHONG BIO provides custom synthesis services for 对氯苯基丁烯氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.