4-氯苯乙烯氧化物
TL;DR: 4-氯苯乙烯氧化物 (CAS 21019-52-3) is a chemical compound with molecular formula C8H7ClO and molecular weight 154.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯苯乙烯氧化物
2-(4-chlorophenyl)oxirane
Also Known As: 2-(4-Chlorophenyl)oxirane, 4-Chlorostyrene oxide, p-Chlorostyrene oxide, (p-Chlorophenyl)oxirane, Oxirane, (4-chlorophenyl)-
| Molecular Formula | C8H7ClO |
|---|---|
| Molecular Weight | 154.02 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.01854 |
| Heavy Atoms | 10 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 21019-52-3 |
|---|---|
| SMILES | C1C(O1)C2=CC=C(C=C2)Cl |
| InChIKey | IBWLXNDOMYKTAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氯苯乙烯氧化物 (CAS 21019-52-3), with molecular formula C8H7ClO and molecular weight 154.02 g/mol. IUPAC: 2-(4-chlorophenyl)oxirane.
Chemical Property Profile of 4-氯苯乙烯氧化物
Property Insights of 4-氯苯乙烯氧化物
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氯苯乙烯氧化物. With a topological polar surface area (TPSA) of 12.5 Ų, 4-氯苯乙烯氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氯苯乙烯氧化物 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 4-氯苯乙烯氧化物?
The CAS number of 4-氯苯乙烯氧化物 is 21019-52-3.
What is the molecular formula of 4-氯苯乙烯氧化物?
The molecular formula of 4-氯苯乙烯氧化物 is C8H7ClO.
What is the molecular weight of 4-氯苯乙烯氧化物?
The molecular weight of 4-氯苯乙烯氧化物 is 154.02 g/mol.
Where can I buy 4-氯苯乙烯氧化物?
You can request a quote for 4-氯苯乙烯氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯苯乙烯氧化物?
Yes, KEHONG BIO provides custom synthesis services for 4-氯苯乙烯氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.