7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-
TL;DR: 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- (CAS 35178-55-3) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-methyl-3-propan-2-ylidene-7-oxabicyclo[4.1.0]heptan-2-one
Also Known As: Piperitenone oxide, Rotundifolone, Rotundifolon, Piperitenoneoxide, 1,2-Epoxy-p-menth-4(8)-en-3-one
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 274.0 |
| Melting Point | 27.5 °C |
| Solubility | Soluble in water |
Chemical Identifiers
| CAS Number | 35178-55-3 |
|---|---|
| SMILES | CC(=C1CCC2(C(C1=O)O2)C)C |
| InChIKey | AKASWINDKIEEBO-UHFFFAOYSA-N |
Product Overview
7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- (CAS 35178-55-3), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 6-methyl-3-propan-2-ylidene-7-oxabicyclo[4.1.0]heptan-2-one.
Chemical Property Profile of 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-
Property Insights of 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-. With a topological polar surface area (TPSA) of 29.6 Ų, 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- 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 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-?
The CAS number of 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- is 35178-55-3.
What is the molecular formula of 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-?
The molecular formula of 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- is C10H14O2.
What is the molecular weight of 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-?
The molecular weight of 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- is 166.10 g/mol.
Where can I buy 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-?
You can request a quote for 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)-?
Yes, KEHONG BIO provides custom synthesis services for 7-Oxabicyclo4.1.0heptan-2-one, 6-methyl-3-(1-methylethylidene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.