1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan
TL;DR: 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan (CAS 3712-92-3) is a chemical compound with molecular formula C13H18O3 and molecular weight 222.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
10-(oxiran-2-ylmethoxy)-4-oxatetracyclo[6.2.1.02,7.03,5]undecane
Also Known As: 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan, 1,2-Epoxy-6-(glycidyloxy)hexahydro-4,7-methanoindane, 3-(oxiran-2-ylmethoxy)octahydro-1ah-2,5-methanoindeno[1,2-b]oxirene, 9-(Glycidyloxy)-5-oxatetracyclo[6.2.1.02,7.04,6]undecane, 10-[(oxiran-2-yl)methoxy]-4-oxatetracyclo[6.2.1.02,7.03,5]undecane
| Molecular Formula | C13H18O3 |
|---|---|
| Molecular Weight | 222.13 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 34.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 222.1256 |
| Heavy Atoms | 16 |
| Complexity | 331.0 |
Chemical Identifiers
| CAS Number | 3712-92-3 |
|---|---|
| SMILES | C1C2CC(C1C3C2CC4C3O4)OCC5CO5 |
| InChIKey | NJBGVARMYOOVSX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan (CAS 3712-92-3), with molecular formula C13H18O3 and molecular weight 222.13 g/mol. IUPAC: 10-(oxiran-2-ylmethoxy)-4-oxatetracyclo[6.2.1.02,7.03,5]undecane.
Chemical Property Profile of 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan
Property Insights of 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan. With a topological polar surface area (TPSA) of 34.3 Ų, 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan has 0 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 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan?
The CAS number of 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan is 3712-92-3.
What is the molecular formula of 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan?
The molecular formula of 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan is C13H18O3.
What is the molecular weight of 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan?
The molecular weight of 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan is 222.13 g/mol.
Where can I buy 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan?
You can request a quote for 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Epoxy-6-(2,3-epoxypropoxy)hexahydro-4,7-methanoindan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.