3-Methyl-7-oxabicyclo(4.1.0)heptane
TL;DR: 3-Methyl-7-oxabicyclo(4.1.0)heptane (CAS 36330-86-6) is a chemical compound with molecular formula C7H12O and molecular weight 112.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-7-oxabicyclo[4.1.0]heptane
Also Known As: 3-Methyl-7-oxabicyclo[4.1.0]heptane, 4-METHYL-1,2-CYCLOHEXENE OXIDE, 1,2-epoxy-4-methyl-cyclohexane, 7-Oxabicyclo[4.1.0]heptane, 3-methyl-, 4-METHYL-1,2-CYCLOHEXENEOXIDE
| Molecular Formula | C7H12O |
|---|---|
| Molecular Weight | 112.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 112.08881 |
| Heavy Atoms | 8 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 36330-86-6 |
|---|---|
| SMILES | CC1CCC2C(C1)O2 |
| InChIKey | ULPDSNLBZMHGPI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Methyl-7-oxabicyclo(4.1.0)heptane (CAS 36330-86-6), with molecular formula C7H12O and molecular weight 112.09 g/mol. IUPAC: 3-methyl-7-oxabicyclo[4.1.0]heptane.
Chemical Property Profile of 3-Methyl-7-oxabicyclo(4.1.0)heptane
Property Insights of 3-Methyl-7-oxabicyclo(4.1.0)heptane
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-7-oxabicyclo(4.1.0)heptane. With a topological polar surface area (TPSA) of 12.5 Ų, 3-Methyl-7-oxabicyclo(4.1.0)heptane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-7-oxabicyclo(4.1.0)heptane 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 3-Methyl-7-oxabicyclo(4.1.0)heptane?
The CAS number of 3-Methyl-7-oxabicyclo(4.1.0)heptane is 36330-86-6.
What is the molecular formula of 3-Methyl-7-oxabicyclo(4.1.0)heptane?
The molecular formula of 3-Methyl-7-oxabicyclo(4.1.0)heptane is C7H12O.
What is the molecular weight of 3-Methyl-7-oxabicyclo(4.1.0)heptane?
The molecular weight of 3-Methyl-7-oxabicyclo(4.1.0)heptane is 112.09 g/mol.
Where can I buy 3-Methyl-7-oxabicyclo(4.1.0)heptane?
You can request a quote for 3-Methyl-7-oxabicyclo(4.1.0)heptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-7-oxabicyclo(4.1.0)heptane?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-7-oxabicyclo(4.1.0)heptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.