2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile
TL;DR: 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile (CAS 13093-87-3) is a chemical compound with molecular formula C15H17NO2 and molecular weight 243.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(oxan-2-yloxy)-1,3-dihydroindene-2-carbonitrile
Also Known As: 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile, 2-(oxan-2-yloxy)-1,3-dihydroindene-2-carbonitrile, 2-Cyano-2-(2'-tetrahydropyranyloxy)-indan, 2-tetrahydropyran-2-yloxyindane-2-carbonitrile, 1H-Indene-2-carbonitrile,2,3-dihydro-2-[(tetrahydro-2H-pyran-2-yl)oxy]-
| Molecular Formula | C15H17NO2 |
|---|---|
| Molecular Weight | 243.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 42.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 243.12593 |
| Heavy Atoms | 18 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 13093-87-3 |
|---|---|
| SMILES | C1CCOC(C1)OC2(CC3=CC=CC=C3C2)C#N |
| InChIKey | DURQZMZVCBQYOT-UHFFFAOYSA-N |
Product Overview
2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile (CAS 13093-87-3), with molecular formula C15H17NO2 and molecular weight 243.13 g/mol. IUPAC: 2-(oxan-2-yloxy)-1,3-dihydroindene-2-carbonitrile.
Chemical Property Profile of 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile
Property Insights of 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile. With a topological polar surface area (TPSA) of 42.3 Ų, 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile 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 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile?
The CAS number of 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile is 13093-87-3.
What is the molecular formula of 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile?
The molecular formula of 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile is C15H17NO2.
What is the molecular weight of 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile?
The molecular weight of 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile is 243.13 g/mol.
Where can I buy 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile?
You can request a quote for 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Tetrahydro-2H-pyran-2-yloxy)-2-indanecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.