Piperitone oxide, (1S,2S,4R)-
TL;DR: Piperitone oxide, (1S,2S,4R)- (CAS 4713-38-6) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3R,6S)-6-methyl-3-propan-2-yl-7-oxabicyclo[4.1.0]heptan-2-one
Also Known As: Piperitone oxide, trans-piperitone oxide, Piperitone oxide, (1S,2S,4R)-, (1S,2S,4R)-cis-Piperitone, (-)-(1S,2S,4R)-cis-Piperitone oxide
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 1.779 |
| Topological Polar Surface Area | 29.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 221.87846 |
Chemical Identifiers
| CAS Number | 4713-38-6 |
|---|---|
| SMILES | CC(C)[C@H]1CC[C@]2([C@@H](C1=O)O2)C |
Product Overview
Piperitone oxide, (1S,2S,4R)- (CAS 4713-38-6), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: (1S,3R,6S)-6-methyl-3-propan-2-yl-7-oxabicyclo[4.1.0]heptan-2-one.
Chemical Property Profile of Piperitone oxide, (1S,2S,4R)-
Property Insights of Piperitone oxide, (1S,2S,4R)-
The XLogP value of 1.779 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperitone oxide, (1S,2S,4R)-. With a topological polar surface area (TPSA) of 29.6 Ų, Piperitone oxide, (1S,2S,4R)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperitone oxide, (1S,2S,4R)- 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 Piperitone oxide, (1S,2S,4R)-?
The CAS number of Piperitone oxide, (1S,2S,4R)- is 4713-38-6.
What is the molecular formula of Piperitone oxide, (1S,2S,4R)-?
The molecular formula of Piperitone oxide, (1S,2S,4R)- is C10H16O2.
What is the molecular weight of Piperitone oxide, (1S,2S,4R)-?
The molecular weight of Piperitone oxide, (1S,2S,4R)- is 168.12 g/mol.
Where can I buy Piperitone oxide, (1S,2S,4R)-?
You can request a quote for Piperitone oxide, (1S,2S,4R)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piperitone oxide, (1S,2S,4R)-?
Yes, KEHONG BIO provides custom synthesis services for Piperitone oxide, (1S,2S,4R)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.