![1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine structure](/static/products/610/61045-71-4.png)
1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine
TL;DR: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine (CAS 61045-71-4) is a chemical compound with molecular formula C14H19NO2 and molecular weight 233.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine
Also Known As: Piperoxan, (S)-Piperoxan, (S)-2beta-(Piperidinomethyl)-2,3-dihydro-1,4-benzodioxin, 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine, 1-{[(2S)-2,3-dihydro-1,4-benzodioxin-2-yl]methyl}piperidine
| Molecular Formula | C14H19NO2 |
|---|---|
| Molecular Weight | 233.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 21.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.14159 |
| Heavy Atoms | 17 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 61045-71-4 |
|---|---|
| SMILES | C1CCN(CC1)C[C@H]2COC3=CC=CC=C3O2 |
| InChIKey | LYKMMUBOEFYJQG-LBPRGKRZSA-N |
Product Overview
1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine (CAS 61045-71-4), with molecular formula C14H19NO2 and molecular weight 233.14 g/mol. IUPAC: 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine.
Chemical Property Profile of 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine
Property Insights of 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine. With a topological polar surface area (TPSA) of 21.7 Ų, 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine 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-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine?
The CAS number of 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine is 61045-71-4.
What is the molecular formula of 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine?
The molecular formula of 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine is C14H19NO2.
What is the molecular weight of 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine?
The molecular weight of 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine is 233.14 g/mol.
Where can I buy 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine?
You can request a quote for 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine?
Yes, KEHONG BIO provides custom synthesis services for 1-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]piperidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.