Phenol, 2-methoxy-4-(2-oxiranylmethyl)-
TL;DR: Phenol, 2-methoxy-4-(2-oxiranylmethyl)- (CAS 53940-49-1) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-4-(oxiran-2-ylmethyl)phenol
Also Known As: Eugenol oxide, Eugeno-2',3'-oxide, 2-Methoxy-4-(oxiranylmethyl)phenol, 2-methoxy-4-(oxiran-2-ylmethyl)phenol, 4-(Epoxypropane)-2-methoxyphenol
| Molecular Formula | C10H12O3 |
|---|---|
| Molecular Weight | 180.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.07864 |
| Heavy Atoms | 13 |
| Complexity | 172.0 |
Chemical Identifiers
| CAS Number | 53940-49-1 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)CC2CO2)O |
| InChIKey | WQAPNRUAKQGQLB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2-methoxy-4-(2-oxiranylmethyl)- (CAS 53940-49-1), with molecular formula C10H12O3 and molecular weight 180.08 g/mol. IUPAC: 2-methoxy-4-(oxiran-2-ylmethyl)phenol.
Chemical Property Profile of Phenol, 2-methoxy-4-(2-oxiranylmethyl)-
Property Insights of Phenol, 2-methoxy-4-(2-oxiranylmethyl)-
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenol, 2-methoxy-4-(2-oxiranylmethyl)-. With a topological polar surface area (TPSA) of 42.0 Ų, Phenol, 2-methoxy-4-(2-oxiranylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2-methoxy-4-(2-oxiranylmethyl)- has 1 hydrogen bond donor(s) and 3 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 Phenol, 2-methoxy-4-(2-oxiranylmethyl)-?
The CAS number of Phenol, 2-methoxy-4-(2-oxiranylmethyl)- is 53940-49-1.
What is the molecular formula of Phenol, 2-methoxy-4-(2-oxiranylmethyl)-?
The molecular formula of Phenol, 2-methoxy-4-(2-oxiranylmethyl)- is C10H12O3.
What is the molecular weight of Phenol, 2-methoxy-4-(2-oxiranylmethyl)-?
The molecular weight of Phenol, 2-methoxy-4-(2-oxiranylmethyl)- is 180.08 g/mol.
Where can I buy Phenol, 2-methoxy-4-(2-oxiranylmethyl)-?
You can request a quote for Phenol, 2-methoxy-4-(2-oxiranylmethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2-methoxy-4-(2-oxiranylmethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2-methoxy-4-(2-oxiranylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.