2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile
TL;DR: 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile (CAS 484646-95-9) is a chemical compound with molecular formula C17H18N2O and molecular weight 266.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-5,6-dimethyl-6-phenylcyclohex-3-ene-1,1-dicarbonitrile
Also Known As: 2-methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile, 2-methoxy-5,6-dimethyl-6-phenylcyclohex-3-ene-1,1-dicarbonitrile
| Molecular Formula | C17H18N2O |
|---|---|
| Molecular Weight | 266.14 g/mol |
| LogP | 3.19876 |
| Topological Polar Surface Area | 56.81 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.1419 |
| Heavy Atoms | 20 |
| Complexity | 579.6563 |
Chemical Identifiers
| CAS Number | 484646-95-9 |
|---|---|
| SMILES | CC1C=CC(C(C1(C)C2=CC=CC=C2)(C#N)C#N)OC |
Product Overview
2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile (CAS 484646-95-9), with molecular formula C17H18N2O and molecular weight 266.14 g/mol. IUPAC: 2-methoxy-5,6-dimethyl-6-phenylcyclohex-3-ene-1,1-dicarbonitrile.
Chemical Property Profile of 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile
Property Insights of 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile
The XLogP value of 3.19876 indicates that 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.81 Ų, 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile 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-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile?
The CAS number of 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile is 484646-95-9.
What is the molecular formula of 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile?
The molecular formula of 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile is C17H18N2O.
What is the molecular weight of 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile?
The molecular weight of 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile is 266.14 g/mol.
Where can I buy 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile?
You can request a quote for 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Methoxy-5,6-dimethyl-6-phenyl-3-cyclohexene-1,1-dicarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.