![2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate structure](/static/products/901/90125-48-7.png)
2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate
TL;DR: 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate (CAS 90125-48-7) is a chemical compound with molecular formula C9H14O4 and molecular weight 186.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate
Also Known As: 2-hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate, 2-hydroxyethyl 7-oxabicyclo[4.1.0]heptane-4-carboxylate, 3-methyl-3-chloromethyl-6-isopropylidene-1,4-cyclohexadiene, 7-Oxabicyclo[4.1.0]heptane-3-carboxylicacid,2-hydroxyethylester, 7-OXABICYCLO[4.1.0]HEPTANE-3-CARBOXYLIC ACID 2-HYDROXYETHYL ESTER
| Molecular Formula | C9H14O4 |
|---|---|
| Molecular Weight | 186.09 g/mol |
| LogP | 0.0894 |
| Topological Polar Surface Area | 59.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.0892 |
| Heavy Atoms | 13 |
| Complexity | 203.79138 |
Chemical Identifiers
| CAS Number | 90125-48-7 |
|---|---|
| SMILES | C1CC2C(O2)CC1C(=O)OCCO |
Product Overview
2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate (CAS 90125-48-7), with molecular formula C9H14O4 and molecular weight 186.09 g/mol. IUPAC: 2-hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate.
Chemical Property Profile of 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate
Property Insights of 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate
The XLogP value of 0.0894 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate. With a topological polar surface area (TPSA) of 59.06 Ų, 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate has 1 hydrogen bond donor(s) and 4 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-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate?
The CAS number of 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate is 90125-48-7.
What is the molecular formula of 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate?
The molecular formula of 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate is C9H14O4.
What is the molecular weight of 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate?
The molecular weight of 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate is 186.09 g/mol.
Where can I buy 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate?
You can request a quote for 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxyethyl 7-oxabicyclo[4.1.0]heptane-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.