2,2-Dimethyl-3-propyloxirane
TL;DR: 2,2-Dimethyl-3-propyloxirane (CAS 17612-35-0) is a chemical compound with molecular formula C7H14O and molecular weight 114.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-3-propyloxirane
Also Known As: 2,2-DIMETHYL-3-PROPYLOXIRANE, Hexane, 2,3-epoxy-2-methyl-, 2,3-Epoxy-2-methylhexane, Oxirane, 2,2-dimethyl-3-propyl-, 2,2-Dimethyl-3-propyloxirane #
| Molecular Formula | C7H14O |
|---|---|
| Molecular Weight | 114.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 114.10446 |
| Heavy Atoms | 8 |
| Complexity | 86.0 |
Chemical Identifiers
| CAS Number | 17612-35-0 |
|---|---|
| SMILES | CCCC1C(O1)(C)C |
| InChIKey | ZWMFGIJPJXEKCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Dimethyl-3-propyloxirane (CAS 17612-35-0), with molecular formula C7H14O and molecular weight 114.10 g/mol. IUPAC: 2,2-dimethyl-3-propyloxirane.
Chemical Property Profile of 2,2-Dimethyl-3-propyloxirane
Property Insights of 2,2-Dimethyl-3-propyloxirane
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-3-propyloxirane. With a topological polar surface area (TPSA) of 12.5 Ų, 2,2-Dimethyl-3-propyloxirane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-Dimethyl-3-propyloxirane 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 2,2-Dimethyl-3-propyloxirane?
The CAS number of 2,2-Dimethyl-3-propyloxirane is 17612-35-0.
What is the molecular formula of 2,2-Dimethyl-3-propyloxirane?
The molecular formula of 2,2-Dimethyl-3-propyloxirane is C7H14O.
What is the molecular weight of 2,2-Dimethyl-3-propyloxirane?
The molecular weight of 2,2-Dimethyl-3-propyloxirane is 114.10 g/mol.
Where can I buy 2,2-Dimethyl-3-propyloxirane?
You can request a quote for 2,2-Dimethyl-3-propyloxirane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dimethyl-3-propyloxirane?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-3-propyloxirane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.