2-((1-Methylethoxy)methyl)oxirane
TL;DR: 2-((1-Methylethoxy)methyl)oxirane (CAS 4016-14-2) is a chemical compound with molecular formula C6H12O2 and molecular weight 116.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(propan-2-yloxymethyl)oxirane
Also Known As: Glycidyl isopropyl ether, ISOPROPYL GLYCIDYL ETHER, (Isopropoxymethyl)oxirane, glycidylisopropylether, 2-(Isopropoxymethyl)oxirane
| Molecular Formula | C6H12O2 |
|---|---|
| Molecular Weight | 116.08 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 21.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 116.08373 |
| Heavy Atoms | 8 |
| Complexity | 70.0 |
| Boiling Point | 127.2 °C at 760 mmHg |
| Density | 0.92 - Less dense than water; will float |
| Solubility | greater than or equal to 100 mg/mL at 66 °F (NTP, 1992) |
| Flash Point | 33.3 °C |
| Vapor Pressure | 9.4 mmHg at 25.0 °C |
Chemical Identifiers
| CAS Number | 4016-14-2 |
|---|---|
| SMILES | CC(C)OCC1CO1 |
| InChIKey | NWLUZGJDEZBBRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((1-Methylethoxy)methyl)oxirane (CAS 4016-14-2), with molecular formula C6H12O2 and molecular weight 116.08 g/mol. IUPAC: 2-(propan-2-yloxymethyl)oxirane.
Chemical Property Profile of 2-((1-Methylethoxy)methyl)oxirane
Property Insights of 2-((1-Methylethoxy)methyl)oxirane
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((1-Methylethoxy)methyl)oxirane. With a topological polar surface area (TPSA) of 21.8 Ų, 2-((1-Methylethoxy)methyl)oxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-((1-Methylethoxy)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-((1-Methylethoxy)methyl)oxirane?
The CAS number of 2-((1-Methylethoxy)methyl)oxirane is 4016-14-2.
What is the molecular formula of 2-((1-Methylethoxy)methyl)oxirane?
The molecular formula of 2-((1-Methylethoxy)methyl)oxirane is C6H12O2.
What is the molecular weight of 2-((1-Methylethoxy)methyl)oxirane?
The molecular weight of 2-((1-Methylethoxy)methyl)oxirane is 116.08 g/mol.
Where can I buy 2-((1-Methylethoxy)methyl)oxirane?
You can request a quote for 2-((1-Methylethoxy)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-((1-Methylethoxy)methyl)oxirane?
Yes, KEHONG BIO provides custom synthesis services for 2-((1-Methylethoxy)methyl)oxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.