2-((4-Methoxyphenyl)methyl)oxirane
TL;DR: 2-((4-Methoxyphenyl)methyl)oxirane (CAS 51410-45-8) is a chemical compound with molecular formula C10H12O2 and molecular weight 164.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxyphenyl)methyl]oxirane
Also Known As: 2-[(4-methoxyphenyl)methyl]oxirane, Estragole oxide, Estragole-2',3'-oxide, p-Methoxyphenylpropylene oxide, 4-Glycidylanisole
| Molecular Formula | C10H12O2 |
|---|---|
| Molecular Weight | 164.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.08372 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 51410-45-8 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2CO2 |
| InChIKey | CLOGCPPDCZMWGQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((4-Methoxyphenyl)methyl)oxirane (CAS 51410-45-8), with molecular formula C10H12O2 and molecular weight 164.08 g/mol. IUPAC: 2-[(4-methoxyphenyl)methyl]oxirane.
Chemical Property Profile of 2-((4-Methoxyphenyl)methyl)oxirane
Property Insights of 2-((4-Methoxyphenyl)methyl)oxirane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((4-Methoxyphenyl)methyl)oxirane. With a topological polar surface area (TPSA) of 21.8 Ų, 2-((4-Methoxyphenyl)methyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((4-Methoxyphenyl)methyl)oxirane has 0 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 2-((4-Methoxyphenyl)methyl)oxirane?
The CAS number of 2-((4-Methoxyphenyl)methyl)oxirane is 51410-45-8.
What is the molecular formula of 2-((4-Methoxyphenyl)methyl)oxirane?
The molecular formula of 2-((4-Methoxyphenyl)methyl)oxirane is C10H12O2.
What is the molecular weight of 2-((4-Methoxyphenyl)methyl)oxirane?
The molecular weight of 2-((4-Methoxyphenyl)methyl)oxirane is 164.08 g/mol.
Where can I buy 2-((4-Methoxyphenyl)methyl)oxirane?
You can request a quote for 2-((4-Methoxyphenyl)methyl)oxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((4-Methoxyphenyl)methyl)oxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-((4-Methoxyphenyl)methyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.