6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile
TL;DR: 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile (CAS 306977-89-9) is a chemical compound with molecular formula C15H13ClN2O and molecular weight 272.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-chlorophenyl)-2-propan-2-yloxypyridine-3-carbonitrile
Also Known As: 6-(2-chlorophenyl)-2-isopropoxynicotinonitrile, 12H-533S, 6-(2-chlorophenyl)-2-propan-2-yloxypyridine-3-carbonitrile, 6-(2-chlorophenyl)-2-(propan-2-yloxy)pyridine-3-carbonitrile, 6-(2-chlorophenyl)-2-isopropoxypyridine-3-carbonitrile
| Molecular Formula | C15H13ClN2O |
|---|---|
| Molecular Weight | 272.07 g/mol |
| LogP | 4.06088 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 272.07166 |
| Heavy Atoms | 19 |
| Complexity | 632.28296 |
Chemical Identifiers
| CAS Number | 306977-89-9 |
|---|---|
| SMILES | CC(C)OC1=C(C=CC(=N1)C2=CC=CC=C2Cl)C#N |
Product Overview
6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile (CAS 306977-89-9), with molecular formula C15H13ClN2O and molecular weight 272.07 g/mol. IUPAC: 6-(2-chlorophenyl)-2-propan-2-yloxypyridine-3-carbonitrile.
Chemical Property Profile of 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile
Property Insights of 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile
The XLogP value of 4.06088 indicates that 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile 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 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile?
The CAS number of 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile is 306977-89-9.
What is the molecular formula of 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile?
The molecular formula of 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile is C15H13ClN2O.
What is the molecular weight of 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile?
The molecular weight of 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile is 272.07 g/mol.
Where can I buy 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile?
You can request a quote for 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 6-(2-Chlorophenyl)-2-isopropoxynicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.