2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile
TL;DR: 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile (CAS 86475-25-4) is a chemical compound with molecular formula C16H21NO6 and molecular weight 323.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile
Also Known As: Propene, 2-cyano-3-methoxy-1-[2,3,4,5,6-pentamethoxyphenyl]-
| Molecular Formula | C16H21NO6 |
|---|---|
| Molecular Weight | 323.14 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 79.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 323.1369 |
| Heavy Atoms | 23 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 86475-25-4 |
|---|---|
| SMILES | COCC(=CC1=C(C(=C(C(=C1OC)OC)OC)OC)OC)C#N |
| InChIKey | BWBHGLCYKVXAED-UHFFFAOYSA-N |
Product Overview
2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile (CAS 86475-25-4), with molecular formula C16H21NO6 and molecular weight 323.14 g/mol. IUPAC: 2-(methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile.
Chemical Property Profile of 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile
Property Insights of 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile. The TPSA of 79.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile. Following Lipinski's Rule of Five, 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile has 0 hydrogen bond donor(s) and 7 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-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile?
The CAS number of 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile is 86475-25-4.
What is the molecular formula of 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile?
The molecular formula of 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile is C16H21NO6.
What is the molecular weight of 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile?
The molecular weight of 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile is 323.14 g/mol.
Where can I buy 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile?
You can request a quote for 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methoxymethyl)-3-(2,3,4,5,6-pentamethoxyphenyl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.